Apobuscopan
Product Code
TRC-A727000
CAS Number
Product Format
Neat
Molecular Formula
C21 H28 N O3 . Br
Molecular Weight
422.36
Product Categories
TRC, Pharmaceutical, Veterinary Compound & Metabolite Reference Materials
Product Type
MetaboliteAlternate CAS Number
Documentation
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Product Information
Chemical Data
Analyte Name
Apohyoscine Butylbromide
CAS Number
92714-23-3
Molecular Formula
C21 H28 N O3 . Br
Molecular Weight
422.36
Accurate Mass
421.1253
SMILES
[Br-].CCCC[N@@+]1(C)[C@@H]2C[C@H](C[C@H]1[C@@H]3O[C@H]23)OC(=O)C(=C)c4ccccc4
InChI
/h6-10,16-20H,2,4-5,11-13H2,1,3H3, /p-1/t16-,17-,18+,19-,20+,22+, InChI=1S/C21H28NO3.BrH/c1-4-5-11-22(3)17-12-16(13-18(22)20-19(17)25-20)24-21(23)14(2)15-9-7-6-8-10-15, 1H/q+1
Alternate CAS Number
Free amine: 786598-71-8
Product Data
Storage Temperature
-20°C
Shipping Temperature
Room Temperature
Country of Origin
CANADA
Product Format
Neat
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