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4-dimethylamino-2-isopropyl-2-phenyl-valeronitrile
SpectraBase Compound ID 6oXSYJPBxCq
InChI InChI=1S/C16H24N2/c1-13(2)16(12-17,11-14(3)18(4)5)15-9-7-6-8-10-15/h6-10,13-14H,11H2,1-5H3
InChIKey WFLSCFISQHLEED-UHFFFAOYSA-N
Mol Weight 244.38 g/mol
Molecular Formula C16H24N2
Exact Mass 244.193949 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID AvYyY9rpywB
Name Isoaminile
CAS Registry Number 77-51-0
Classification Antitussive
Copyright Copyright © 2023-2024 Wiley-VCH GmbH. All Rights Reserved.
Exact Mass 244.193948781 u
Formula C16H24N2
InChI InChI=1S/C16H24N2/c1-13(2)16(12-17,11-14(3)18(4)5)15-9-7-6-8-10-15/h6-10,13-14H,11H2,1-5H3
InChIKey WFLSCFISQHLEED-UHFFFAOYSA-N
Ionization Type Electron Ionization (EI)
Molecular Weight 244.382 g/mol
SMILES C(CC(N(C)C)C)(C#N)(c1ccccc1)C(C)C
SPLASH splash10-00di-9000000000-dd4c04d834457444094b
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: U UHY UHYAC
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_4389