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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 5OzTQvppVcR
Name Ketamine isomer
CAS Registry Number 6740-88-1
Classification Anesthetic
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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
SMILES c1ccc(c(C2(C(CCCC2)=O)NC)c1)Cl
SPLASH splash10-0udi-1900000000-1633a4cf8b8e5dbb163e
Sample Comments The MMPW Reference Handbook and associated Tables are attached to Record #1, under the Attachments tab. Refer to these references for an explanation of the Sample Preparation Procedure "Detected" abbreviations, as well as other relevant information pertaining to this database.
Sample Preparation Procedure Detected: G P
Source of Spectrum H.H.Maurer, M.Meyer, K.Pfleger, A.A. Weber / University of Saarland, D-66424 Homburg Germany
Technique GC/MS
Wiley ID MMPW6e_5561