meta-Hydroxybenzoylecgonine-D3
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- structure.search.product.name meta-Hydroxybenzoylecgonine-D3
- Product Code: TRC-H808552
- CAS Number: 253775-21-2
- Brand: TRC
Product Overview
Product Code
TRC-H808552
CAS Number
Product Format
Neat
Molecular Formula
C16H16D3NO5
Molecular Weight
308.34
Product Categories
TRC, Chiral Molecules , Reference Materials for Cocaine and Related Substances , Additional Neuro Products, Stable isotopes, Stable Isotope Labelled Analytical Standards
Unlabelled CAS Number
Drug Type
Cocaine Analogs
Documentation
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Product Information
Chemical Data
Analyte Name
meta-Hydroxybenzoylecgonine-D3
CAS Number
253775-21-2
Molecular Formula
C16H16D3NO5
Molecular Weight
308.34
Accurate Mass
308.1452
SMILES
O=C(C1=CC(O)=CC=C1)O[C@@H]2[C@H](C(O)=O)[C@H]3CC[C@@H](C2)N3C([2H])([2H])[2H]
InChI
InChI=1S/C16H19NO5/c1-17-10-5-6-12(17)14(15(19)20)13(8-10)22-16(21)9-3-2-4-11(18)7-9/h2-4,7,10,12-14,18H,5-6,8H2,1H3,(H,19,20)/t10-,12+,13-,14+/m0/s1/i1D3
IUPAC
(1S,3S,4R,5R)-3-(3-hydroxybenzoyl)oxy-8-(trideuteriomethyl)-8-azabicyclo[3.2.1]octane-4-carboxylic acid
Unlabelled CAS Number
129944-99-6
SIL Type
Deuterium
Product Data
Storage Temperature
-20°C
Shipping Temperature
Room Temperature
Country of Origin
CANADA
Product Type
Stable Isotope Labelled; API
Product Format
Neat
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