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

*Links on SpectraBase are not permalinks.

Demethylisoxaben

View entire compound with spectra: 1 MS (GC)

Demethylisoxaben
SpectraBase Compound ID KjxvTeOOVM1
InChI InChI=1S/C17H22N2O4/c1-5-17(3,6-2)13-10-14(23-19-13)18-16(21)15-11(20)8-7-9-12(15)22-4/h7-10,20H,5-6H2,1-4H3,(H,18,21)
InChIKey HFKHOPPGLCXGGH-UHFFFAOYSA-N
Mol Weight 318.37 g/mol
Molecular Formula C17H22N2O4
Exact Mass 318.157957 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 CwpBNcBlFOd
Name Demethylisoxaben
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C17H22N2O4
InChI InChI=1S/C17H22N2O4/c1-5-17(3,6-2)13-10-14(23-19-13)18-16(21)15-11(20)8-7-9-12(15)22-4/h7-10,20H,5-6H2,1-4H3,(H,18,21)
InChIKey HFKHOPPGLCXGGH-UHFFFAOYSA-N
Molecular Weight 318.373 g/mol
SMILES Oc1c(C(Nc2cc(C(CC)(CC)C)no2)=O)c(ccc1)OC
SPLASH splash10-014i-0359000000-76fdfa8bac087bb2a348
Source of Spectrum AN-102-562-2
Synonyms Demethoxyisoxaben N-[3'-(1''-Ethyl-1''-methylpropyl)-5'-isoxazolyl]-2-hydroxy-6-methoxybenzamide N-[3-(1-ethyl-1-methylpropyl)-5-isoxazolyl]-2-hydroxy-6-methoxybenzamide
Wiley ID 747289