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Brorphine
SpectraBase Compound ID 7AKtXjVRhql
InChI InChI=1S/C20H22BrN3O/c1-14(15-6-8-16(21)9-7-15)23-12-10-17(11-13-23)24-19-5-3-2-4-18(19)22-20(24)25/h2-9,14,17H,10-13H2,1H3,(H,22,25)
InChIKey CNOFBGYRMCBVLO-UHFFFAOYSA-N
Mol Weight 400.32 g/mol
Molecular Formula C20H22BrN3O
Exact Mass 399.094625 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 8J89WHRCSSO
Name Brorphine
Classification Piperidine opioid designer drug
Copyright Copyright © 2024 DigiLab GmbH and Wiley-VCH GmbH. All Rights Reserved.
DEA Citation 21 CFR §1308.11 (b) (22)
DEA Controlled Substance Name Brorphine
DEA Controlled Substance Type Isomers, esters, ethers, salts, and salts of isomers, esters and et
DEA Controlled Substances Code Number 9098
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 399.094625339 u
Formula C20H22BrN3O
InChI InChI=1S/C20H22BrN3O/c1-14(15-6-8-16(21)9-7-15)23-12-10-17(11-13-23)24-19-5-3-2-4-18(19)22-20(24)25/h2-9,14,17H,10-13H2,1H3,(H,22,25)
InChIKey CNOFBGYRMCBVLO-UHFFFAOYSA-N
Ionization Type Electron Ionization (EI)
Molecular Weight 400.320 g/mol
Nominal Mass 399 u
Retention Index 3350
SMILES C=12N(C(NC2=CC=CC1)=O)C1CCN(C(C=2C=CC(=CC2)Br)C)CC1
SPLASH splash10-001i-9530000000-216a784bb26632823c14
Source of Spectrum DigiLab GmbH (C) 2024
Synonyms 1-[1-[1-(4-Bromophenyl)ethyl]-4-piperidinyl]-1,3-dihydro-2H-benzimidazol-2-one
Technique GC/MS
Wiley ID DD2024_034292