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Perhexiline AC
SpectraBase Compound ID Gz888EpbOHq
InChI InChI=1S/C21H37NO/c1-17(23)22-15-9-8-14-20(22)16-21(18-10-4-2-5-11-18)19-12-6-3-7-13-19/h18-21H,2-16H2,1H3
InChIKey QFUDRHDRGRVGRG-UHFFFAOYSA-N
Mol Weight 319.5 g/mol
Molecular Formula C21H37NO
Exact Mass 319.287515 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID FGAItfnCQKU
Name Perhexiline AC
Classification Ca Antagonist
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Exact Mass 319.287514814 u
Formula C21H37NO
InChI InChI=1S/C21H37NO/c1-17(23)22-15-9-8-14-20(22)16-21(18-10-4-2-5-11-18)19-12-6-3-7-13-19/h18-21H,2-16H2,1H3
InChIKey QFUDRHDRGRVGRG-UHFFFAOYSA-N
Ionization Type Electron Ionization (EI)
Molecular Weight 319.533 g/mol
SMILES C1CC(C(CC2CCCCN2C(C)=O)C2CCCCC2)CCC1
SPLASH splash10-0059-8900000000-ecc789b4739604afb7fa
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.
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_3304