Benzoylecgonine 0.1 mg/ml in Methanol
Product Code
LGCAMP1345.04-02
CAS Number
Product Format
Single Solution
Matrix
Methanol
Molecular Formula
C16 H19 N O4
Molecular Weight
289.33
Product Categories
Reference Materials for Cocaine and Related Substances , LoGiCal
Product Type
MetaboliteDocumentation
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Product Information
Analyte Data
Analyte Name
Benzoylecgonine
CAS Number
519-09-5
Molecular Formula
C16 H19 N O4
Molecular Weight
289.33
Accurate Mass
289.1314
Appearance/Form
Liquid
Flash Point
11
Color
Colourless
Odor
Alcohol-like
SMILES
CN1[C@H]2CC[C@@H]1[C@H]([C@H](C2)OC(=O)c3ccccc3)C(=O)O
InChI
InChI=1S/C16H19NO4/c1-17-11-7-8-12(17)14(15(18)19)13(9-11)21-16(20)10-5-3-2-4-6-10/h2-6,11-14H,7-9H2,1H3,(H,18,19)/t11-,12+,13-,14+/m0/s1
IUPAC
(1S,3S,4R,5R)-3-benzoyloxy-8-methyl-8-azabicyclo[3.2.1]octane-4-carboxylic acid
Product Data
Storage Temperature
-18°C
Shipping Temperature
Ice pack (-20°C)
Country of Origin
GERMANY
Tariff Code
38220000
Product Type
Metabolite
Product Format
Single Solution
Matrix
Methanol
