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Morphinan-6-one, 4,5-epoxy-3-methoxy-17-methyl-, (5.alpha.)-
SpectraBase Compound ID 3f4CXHO33fb
InChI InChI=1S/C18H21NO3/c1-19-8-7-18-11-4-5-13(20)17(18)22-16-14(21-2)6-3-10(15(16)18)9-12(11)19/h3,6,11-12,17H,4-5,7-9H2,1-2H3/t11?,12-,17?,18+/m1/s1
InChIKey LLPOLZWFYMWNKH-QPDIMZNGSA-N
Mol Weight 299.37 g/mol
Molecular Formula C18H21NO3
Exact Mass 299.152144 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 9JuJc3aOpKh
Name Hydrocodone
CAS Registry Number 125-29-1
Classification Pharmaceutical drug, analgesic, antitussive
Comments Spectrum verified by crosschecking against external libraries (one reference spectrum with similarity >= 99% found)
Copyright Copyright © 2024 DigiLab GmbH and Wiley-VCH GmbH. All Rights Reserved.
DEA Citation 21 CFR §1308.12 (b) (1) (vi)
DEA Controlled Substance Name Hydrocodone
DEA Controlled Substance Type Salts
DEA Controlled Substances Code Number 9193
DEA Schedule Schedule II
DEA Section Substances, vegetable origin or chemical synthesis. Unless specifically excepted or unless listed in another schedule, any of the following substances whether produced directly or indirectly by extraction from substances of vegetable origin, or independently by means of chemical synthesis, or by a combination of extraction and chemical synthesis
Exact Mass 299.152143537 u
Formula C18H21NO3
InChI InChI=1S/C18H21NO3/c1-19-8-7-18-11-4-5-13(20)17(18)22-16-14(21-2)6-3-10(15(16)18)9-12(11)19/h3,6,11-12,17H,4-5,7-9H2,1-2H3/t11?,12-,17?,18+/m1/s1
InChIKey LLPOLZWFYMWNKH-QPDIMZNGSA-N
Ionization Type Electron Ionization (EI)
Molecular Weight 299.370 g/mol
Nominal Mass 299 u
Quality 994
Retention Index 2439
SMILES [C@]123C4=C5OC3C(CCC1[C@@](CC4=CC=C5OC)(N(CC2)C)[H])=O
SPLASH splash10-0005-4790000000-d39ab8616c34447f77e7
Source of Spectrum DigiLab GmbH (C) 2024
Synonyms Dihydrocodeinone 4,5alpha-Epoxy-3-methoxy-17-methylmorphinan-6-one
Technique GC/MS
Wiley ID DD2024_033562