For citations & permissions, please see: Citations & Permissions - Wiley Science Solutions*

*Links on SpectraBase are not permalinks.
Cetobemidone
SpectraBase Compound ID F1gBK2hdsvu
InChI InChI=1S/C15H21NO2/c1-3-14(18)15(7-9-16(2)10-8-15)12-5-4-6-13(17)11-12/h4-6,11,17H,3,7-10H2,1-2H3
InChIKey ALFGKMXHOUSVAD-UHFFFAOYSA-N
Mol Weight 247.34 g/mol
Molecular Formula C15H21NO2
Exact Mass 247.157229 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

View the Full Spectrum for FREE!

The full spectrum can only be viewed using a FREE account.

SpectraBase Spectrum ID 2mWaaomMEa0
Name Cetobemidone
CAS Registry Number 469-79-4
Classification Pharmaceutical drug, phenylpiperidine opioid
Copyright Copyright © 2024 DigiLab GmbH and Wiley-VCH GmbH. All Rights Reserved.
DEA Citation 21 CFR §1308.11 (b) (48)
DEA Controlled Substance Name Ketobemidone
DEA Controlled Substance Type Isomers, esters, ethers, salts, and salts of isomers, esters and ethers
DEA Controlled Substances Code Number 9628
DEA Schedule Schedule I
DEA Section (b) Opiates. Unless specifically excepted or unless listed in another schedule, any of the following opiates, including their isomers, esters, ethers, salts, and salts of isomers, esters and ethers, whenever the existence of such isomers, esters, ethers and salts is possible within the specific chemical designation (for purposes of 3-methylthiofentanyl only, the term isomer includes the optical and geometric isomers):
Exact Mass 247.157228918 u
Formula C15H21NO2
InChI InChI=1S/C15H21NO2/c1-3-14(18)15(7-9-16(2)10-8-15)12-5-4-6-13(17)11-12/h4-6,11,17H,3,7-10H2,1-2H3
InChIKey ALFGKMXHOUSVAD-UHFFFAOYSA-N
Ionization Type Electron Ionization (EI)
Molecular Weight 247.338 g/mol
Nominal Mass 247 u
Quality 995
Retention Index 1892
SMILES OC=1C=C(C2(C(CC)=O)CCN(CC2)C)C=CC1
SPLASH splash10-00dl-9420000000-f4322e3637d1d0bfce8b
Source of Spectrum DigiLab GmbH (C) 2024
Synonyms Ketobemidone 1-[4-(3-Hydroxyphenyl)-1-methyl-4-piperidyl]propan-1-one
Technique GC/MS
Wiley ID DD2024_000497