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

*Links on SpectraBase are not permalinks.
Benzoic acid, 2-methoxy-3,6-dimethyl-4-(phenylmethoxy)-
SpectraBase Compound ID 5vFf0a2rgIv
InChI InChI=1S/C17H18O4/c1-11-9-14(21-10-13-7-5-4-6-8-13)12(2)16(20-3)15(11)17(18)19/h4-9H,10H2,1-3H3,(H,18,19)
InChIKey VCHWHRJVTPXCMI-UHFFFAOYSA-N
Mol Weight 286.33 g/mol
Molecular Formula C17H18O4
Exact Mass 286.120509 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 A0yCxI2lzGg
Name Benzoic acid, 2-methoxy-3,6-dimethyl-4-(phenylmethoxy)-
CAS Registry Number 125304-84-9
Comments Less than 3 mono-isotopic peaks
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C17H18O4
InChI InChI=1S/C17H18O4/c1-11-9-14(21-10-13-7-5-4-6-8-13)12(2)16(20-3)15(11)17(18)19/h4-9H,10H2,1-3H3,(H,18,19)
InChIKey VCHWHRJVTPXCMI-UHFFFAOYSA-N
Molecular Weight 286.327 g/mol
SMILES OC(c1c(c(C)c(cc1C)OCc1ccccc1)OC)=O
SPLASH splash10-0006-9000000000-98e3985aa7c21e5dcade
Source of Spectrum B-42-1199-25
Synonyms 4-(benzyloxy)-2-methoxy-3,6-dimethylbenzoic acid
Wiley ID 1289997