For citations & permissions, please see: Citations & Permissions - Wiley Science Solutions*

*Links on SpectraBase are not permalinks.
Perhexiline-M (di-HO-) -H2O 2AC
SpectraBase Compound ID 9eXWd7FXtmZ
InChI InChI=1S/C23H37NO3/c1-17(25)24-15-7-6-10-21(24)16-23(19-8-4-3-5-9-19)20-11-13-22(14-12-20)27-18(2)26/h3-4,19-23H,5-16H2,1-2H3
InChIKey QLXUIYPXQNHFJG-UHFFFAOYSA-N
Mol Weight 375.6 g/mol
Molecular Formula C23H37NO3
Exact Mass 375.277344 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

View the Full Spectrum for FREE!

The full spectrum can only be viewed using a FREE account.

SpectraBase Spectrum ID 4gw8jZ1CUzy
Name Perhexiline-M (di-HO-) -H2O 2AC
Classification Ca Antagonist
Comments Structure comment: Wiggly bond = unknown position of substituent
Copyright Copyright © 2023-2024 Wiley-VCH GmbH. All Rights Reserved.
Exact Mass 375.277344052 u
Formula C23H37NO3
InChI InChI=1S/C23H37NO3/c1-17(25)24-15-7-6-10-21(24)16-23(19-8-4-3-5-9-19)20-11-13-22(14-12-20)27-18(2)26/h3-4,19-23H,5-16H2,1-2H3
InChIKey QLXUIYPXQNHFJG-UHFFFAOYSA-N
Ionization Type Electron Ionization (EI)
Molecular Weight 375.553 g/mol
SMILES C1CC(OC(C)=O)CCC1C(CC1CCCCN1C(C)=O)C1CCC=CC1
SPLASH splash10-0059-8911000000-3bfe5c762b39aea90731
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: 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_3400