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Ketamine
SpectraBase Compound ID CLXcRcCE5lO
InChI InChI=1S/C13H16ClNO/c1-15-13(9-5-4-8-12(13)16)10-6-2-3-7-11(10)14/h2-3,6-7,15H,4-5,8-9H2,1H3
InChIKey YQEZLKZALYSWHR-UHFFFAOYSA-N
Mol Weight 237.73 g/mol
Molecular Formula C13H16ClNO
Exact Mass 237.092042 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID DnPpkiQPSXw
Name Ketamine
CAS Registry Number 6740-88-1
Classification Pharmaceutical drug, anesthetic
Comments Spectrum verified by crosschecking against external libraries (seven reference spectrum with similarity >= 99% found); Spectrum verified by independent measurements in external laboratories
Copyright Copyright © 2024 DigiLab GmbH and Wiley-VCH GmbH. All Rights Reserved.
DEA Citation 21 CFR §1308.13 (c) (7)
DEA Controlled Substance Form Any compound, mixture or preparation
DEA Controlled Substance Name Ketamine
DEA Controlled Substance Type Salts, isomers, and salts of isomers
DEA Controlled Substances Code Number 7285
DEA Schedule Schedule III
DEA Section Depressants. Unless specifically excepted or unless listed in another schedule, any material, compound, mixture, or preparation which contains any quantity of the following substances having a depressant effect on the central nervous system
Exact Mass 237.092041838 u
Formula C13H16ClNO
InChI InChI=1S/C13H16ClNO/c1-15-13(9-5-4-8-12(13)16)10-6-2-3-7-11(10)14/h2-3,6-7,15H,4-5,8-9H2,1H3
InChIKey YQEZLKZALYSWHR-UHFFFAOYSA-N
Ionization Type Electron Ionization (EI)
Molecular Weight 237.730 g/mol
Nominal Mass 237 u
Quality 988
Retention Index 1843
SMILES C1(C=2C(=CC=CC2)Cl)(C(CCCC1)=O)NC
SPLASH splash10-001i-2910000000-608d039a9da7daff2b76
Source of Spectrum DigiLab GmbH (C) 2024
Synonyms 2-(2-Chlorophenyl)-2-methylamino-cyclohexan-1-one
Technique GC/MS
Wiley ID DD2024_024569