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Ketamine-M (-NHCH3,OH)
SpectraBase Compound ID 5yhAYH7xBYv
InChI InChI=1S/C12H11ClO2/c13-11-4-2-1-3-9(11)10-6-5-8(14)7-12(10)15/h1-4,6,8,14H,5,7H2
InChIKey IBSUWXJADZIFNS-UHFFFAOYSA-N
Mol Weight 222.67 g/mol
Molecular Formula C12H11ClO2
Exact Mass 222.044757 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID B6HAywTWS7D
Name Ketamine-M (nor-HO-) -NH3
Classification Anesthetic
Comments Structure comment: Wiggly bond = unknown position of substituent
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Exact Mass 222.044757292 u
Formula C12H11ClO2
InChI InChI=1S/C12H11ClO2/c13-11-4-2-1-3-9(11)10-6-5-8(14)7-12(10)15/h1-4,6,8,14H,5,7H2
InChIKey IBSUWXJADZIFNS-UHFFFAOYSA-N
Ionization Type Electron Ionization (EI)
Molecular Weight 222.671 g/mol
SMILES c1cccc(c1Cl)C1=CCC(CC1=O)O
SPLASH splash10-000i-5910000000-df40e89e67afc869983c
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: P U UHY
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_1053