STM 1/13-A SE
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Product Information
Analyte Data
Analyte Name
Concentration
CAS Number
Molecular Structure
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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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(±)-Methadone hydrochloride
CAS Number
Alternate CAS Number
Free base: 76-99-3; Deleted: 125-56-4; 70172-45-1; 70181-39-4
Unlabelled CAS Number
-
Molecular Formula
C21 H27 N O . Cl H
Molecular Weight
345.91
Accurate Mass
345.1859
SMILES
Cl.CCC(=O)C(CC(C)N(C)C)(c1ccccc1)c2ccccc2
InChI
1H
IUPAC
6-(dimethylamino)-4,4-diphenylheptan-3-one;hydrochloride
Buprenorphine
CAS Number
Alternate CAS Number
Unlabelled CAS Number
-
Molecular Formula
C29 H41 N O4
Molecular Weight
467.64
Accurate Mass
467.3036
SMILES
CO[C@]12CC[C@@]3(C[C@@H]1[C@](C)(O)C(C)(C)C)[C@H]4Cc5ccc(O)c6O[C@@H]2[C@]3(CCN4CC7CC7)c56
InChI
InChI=1S/C29H41NO4/c1-25(2,3)26(4,32)20-15-27-10-11-29(20,33-5)24-28(27)12-13-30(16-17-6-7-17)21(27)14-18-8-9-19(31)23(34-24)22(18)28/h8-9,17,20-21,24,31-32H,6-7,10-16H2,1-5H3/t20-,21-,24-,26+,27-,28+,29?/m1/s1
IUPAC
[5α,7α(S)]-17-(Cyclopropylmethyl)-α-(1,1-dimethylethyl)-4,5-epoxy-18,19-dihydro-3-hydroxy-6-methoxy-α-methyl-6,14-ethenomorphinan-7-methanol
EDDP perchlorate
CAS Number
Alternate CAS Number
-
Unlabelled CAS Number
-
Molecular Formula
C20 H24 N . Cl O4
Molecular Weight
377.86
Accurate Mass
377.1394
SMILES
CCC1=[N+](C)C(C)CC1(c2ccccc2)c3ccccc3.[O-]Cl(=O)(=O)=O
InChI
/p-1
IUPAC
5-ethyl-1,2-dimethyl-4,4-diphenyl-2,3-dihydropyrrol-1-ium;perchlorate
Norbuprenorphine
CAS Number
Alternate CAS Number
-
Unlabelled CAS Number
-
Molecular Formula
C25 H35 N O4
Molecular Weight
413.55
Accurate Mass
413.2566
SMILES
CO[C@]12CC[C@@]3(C[C@@H]1[C@](C)(O)C(C)(C)C)[C@H]4Cc5ccc(O)c6O[C@@H]2[C@]3(CCN4)c56
InChI
InChI=1S/C25H35NO4/c1-21(2,3)22(4,28)16-13-23-8-9-25(16,29-5)20-24(23)10-11-26-17(23)12-14-6-7-15(27)19(30-20)18(14)24/h6-7,16-17,20,26-28H,8-13H2,1-5H3/t16-,17-,20-,22+,23-,24+,25?/m1/s1
Storage & Transport Information
Storage Temperature
+4°C
Shipping Temperature
Room Temperature
Country of Origin
GERMANY
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