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Clobutinol
SpectraBase Compound ID 7AcV0sZe457
InChI InChI=1S/C14H22ClNO/c1-11(10-16(3)4)14(2,17)9-12-5-7-13(15)8-6-12/h5-8,11,17H,9-10H2,1-4H3
InChIKey KVHHQGIIZCJATJ-UHFFFAOYSA-N
Mol Weight 255.79 g/mol
Molecular Formula C14H22ClNO
Exact Mass 255.138992 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID IHj1IbZ9Rpx
Name Clobutinol
CAS Registry Number 14860-49-2
Classification Antitussive
Copyright Copyright © 2023-2024 Wiley-VCH GmbH. All Rights Reserved.
Exact Mass 255.138992031 u
Formula C14H22ClNO
InChI InChI=1S/C14H22ClNO/c1-11(10-16(3)4)14(2,17)9-12-5-7-13(15)8-6-12/h5-8,11,17H,9-10H2,1-4H3
InChIKey KVHHQGIIZCJATJ-UHFFFAOYSA-N
Ionization Type Electron Ionization (EI)
Molecular Weight 255.789 g/mol
SMILES c1(ccc(cc1)CC(C(CN(C)C)C)(O)C)Cl
SPLASH splash10-0a4i-9300000000-439b5b719236b5ad83c6
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 U
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_2793