Organic Contaminants in Smokers' Urine (Frozen)
Product Code
NIST-3672
CAS Number
11 AnalytesPrice and availability
Documentation
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Product Information
Product Notes
LGC Limited is a Licensed Distributor of NIST Standard Reference Materials®, NIST®, STANDARD REFERENCE MATERIAL®, SRM® and depictions or representations thereof, are trademarks and service marks of the National Institute of Standards and Technology of the Department of Commerce. Please register your SRM purchase on the NIST website at www.nist.gov/srm/registration-and-surveys.
Analyte Data
Analyte Name
Concentration
CAS Number
Molecular Structure
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CAS Number
Alternate CAS Number
Unlabelled CAS Number
Molecular Formula
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Molecular Weight
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Accurate Mass
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Melting Point
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Appearance/Form
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SMILES
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InChI
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IUPAC
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1-Hydroxyphenanthrene
CAS Number
Alternate CAS Number
-
Unlabelled CAS Number
-
Molecular Formula
C14 H10 O
Molecular Weight
194.23
Accurate Mass
194.0732
SMILES
Oc1cccc2c1ccc3ccccc23
InChI
InChI=1S/C14H10O/c15-14-7-3-6-12-11-5-2-1-4-10(11)8-9-13(12)14/h1-9,15H
IUPAC
phenanthren-1-ol
1-Hydroxypyrene
CAS Number
Alternate CAS Number
-
Unlabelled CAS Number
-
Molecular Formula
C16 H10 O
Molecular Weight
218.25
Accurate Mass
218.0732
SMILES
Oc1ccc2ccc3cccc4ccc1c2c34
InChI
InChI=1S/C16H10O/c17-14-9-7-12-5-4-10-2-1-3-11-6-8-13(14)16(12)15(10)11/h1-9,17H
IUPAC
pyren-1-ol
1-Naphthol
CAS Number
Alternate CAS Number
-
Unlabelled CAS Number
-
Molecular Formula
C10 H8 O
Molecular Weight
144.17
Accurate Mass
144.0575
SMILES
Oc1cccc2ccccc12
InChI
InChI=1S/C10H8O/c11-10-7-3-5-8-4-1-2-6-9(8)10/h1-7,11H
IUPAC
naphthalen-1-ol
2-Hydroxy Fluorene
CAS Number
Alternate CAS Number
-
Unlabelled CAS Number
-
Molecular Formula
C13 H10 O
Molecular Weight
182.22
Accurate Mass
182.0732
SMILES
Oc1ccc2c(Cc3ccccc23)c1
InChI
InChI=1S/C13H10O/c14-11-5-6-13-10(8-11)7-9-3-1-2-4-12(9)13/h1-6,8,14H,7H2
IUPAC
9H-fluoren-2-ol
2-Hydroxyphenanthrene
CAS Number
Alternate CAS Number
-
Unlabelled CAS Number
-
Molecular Formula
C14 H10 O
Molecular Weight
194.23
Accurate Mass
194.0732
SMILES
Oc1ccc2c(ccc3ccccc23)c1
InChI
InChI=1S/C14H10O/c15-12-7-8-14-11(9-12)6-5-10-3-1-2-4-13(10)14/h1-9,15H
IUPAC
phenanthren-2-ol
3-Hydroxyphenanthrene
CAS Number
Alternate CAS Number
-
Unlabelled CAS Number
-
Molecular Formula
C14 H10 O
Molecular Weight
194.23
Accurate Mass
194.0732
SMILES
Oc1ccc2ccc3ccccc3c2c1
InChI
InChI=1S/C14H10O/c15-12-8-7-11-6-5-10-3-1-2-4-13(10)14(11)9-12/h1-9,15H
IUPAC
phenanthren-3-ol
4-Hydroxy-phenanthrene
CAS Number
Alternate CAS Number
-
Unlabelled CAS Number
-
Molecular Formula
C14 H10 O
Molecular Weight
194.23
Accurate Mass
194.0732
SMILES
Oc1cccc2ccc3ccccc3c12
InChI
InChI=1S/C14H10O/c15-13-7-3-5-11-9-8-10-4-1-2-6-12(10)14(11)13/h1-9,15H
IUPAC
phenanthren-4-ol
9-Hydroxy-phenanthrene
CAS Number
Alternate CAS Number
-
Unlabelled CAS Number
-
Molecular Formula
C14 H10 O
Molecular Weight
194.23
Accurate Mass
194.0732
SMILES
Oc1cc2ccccc2c3ccccc13
InChI
InChI=1S/C14H10O/c15-14-9-10-5-1-2-6-11(10)12-7-3-4-8-13(12)14/h1-9,15H
IUPAC
phenanthren-9-ol
9-Hydroxyfluorene
CAS Number
Alternate CAS Number
-
Unlabelled CAS Number
-
Molecular Formula
C13 H10 O
Molecular Weight
182.22
Accurate Mass
182.0732
SMILES
OC1c2ccccc2c3ccccc13
InChI
InChI=1S/C13H10O/c14-13-11-7-3-1-5-9(11)10-6-2-4-8-12(10)13/h1-8,13-14H
IUPAC
9H-fluoren-9-ol
beta-Naphthol
CAS Number
Alternate CAS Number
-
Unlabelled CAS Number
-
Molecular Formula
C10 H8 O
Molecular Weight
144.17
Accurate Mass
144.0575
SMILES
Oc1ccc2ccccc2c1
InChI
InChI=1S/C10H8O/c11-10-6-5-8-3-1-2-4-9(8)7-10/h1-7,11H
IUPAC
naphthalen-2-ol
Fluoren-3-ol
CAS Number
Alternate CAS Number
-
Unlabelled CAS Number
-
Molecular Formula
C13 H10 O
Molecular Weight
182.22
Accurate Mass
182.0732
SMILES
Oc1ccc2Cc3ccccc3c2c1
InChI
InChI=1S/C13H10O/c14-11-6-5-10-7-9-3-1-2-4-12(9)13(10)8-11/h1-6,8,14H,7H2
IUPAC
9H-fluoren-3-ol
Storage & Transport Information
Storage Temperature
-80°C
Shipping Temperature
Dry ice
Country of Origin
UNITED STATES
Transport Restrictions
Air Excepted Air Dangerous
Tariff Code
38220000
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