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

*Links on SpectraBase are not permalinks.

Pitofenon

View entire compound with spectra: 4 MS (GC)

Pitofenon
SpectraBase Compound ID 7LNzWjUtyb3
InChI InChI=1S/C22H25NO4/c1-26-22(25)20-8-4-3-7-19(20)21(24)17-9-11-18(12-10-17)27-16-15-23-13-5-2-6-14-23/h3-4,7-12H,2,5-6,13-16H2,1H3
InChIKey NZHMAQSCHUSSSJ-UHFFFAOYSA-N
Mol Weight 367.45 g/mol
Molecular Formula C22H25NO4
Exact Mass 367.178358 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 AmAXM0idVEd
Name PITOFENON
Copyright Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved.
Formula C22H25NO4
InChI InChI=1S/C22H25NO4/c1-26-22(25)20-8-4-3-7-19(20)21(24)17-9-11-18(12-10-17)27-16-15-23-13-5-2-6-14-23/h3-4,7-12H,2,5-6,13-16H2,1H3
InChIKey NZHMAQSCHUSSSJ-UHFFFAOYSA-N
Instrument Name GC
Molecular Weight 367.445 g/mol
SMILES c1ccc(C(c2ccc(OCCN3CCCCC3)cc2)=O)c(C(=O)OC)c1
SPLASH splash10-0002-9000000000-0f06b827644c34891464
Source of Spectrum Chemical Concepts, A Wiley Division, Weinheim, Germany