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

*Links on SpectraBase are not permalinks.
Isoamyl salicylate
SpectraBase Compound ID Kx8fgC1b2il
InChI InChI=1S/C12H16O3/c1-9(2)7-8-15-12(14)10-5-3-4-6-11(10)13/h3-6,9,13H,7-8H2,1-2H3
InChIKey PMGCQNGBLMMXEW-UHFFFAOYSA-N
Mol Weight 208.26 g/mol
Molecular Formula C12H16O3
Exact Mass 208.109944 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 DmSkoIyW7ai
Name 2-Hydroxy-benzoic acid 3-methylbutyl ester
CAS Registry Number 87-20-7
Classification Chemical
Comments Spectrum verified by independent measurements in external laboratories
Copyright Copyright © 2024 DigiLab GmbH and Wiley-VCH GmbH. All Rights Reserved.
Exact Mass 208.109944372 u
Formula C12H16O3
InChI InChI=1S/C12H16O3/c1-9(2)7-8-15-12(14)10-5-3-4-6-11(10)13/h3-6,9,13H,7-8H2,1-2H3
InChIKey PMGCQNGBLMMXEW-UHFFFAOYSA-N
Ionization Type Electron Ionization (EI)
Molecular Weight 208.257 g/mol
Nominal Mass 208 u
Quality 993
Retention Index 1500
SMILES OC=1C(C(OCCC(C)C)=O)=CC=CC1
SPLASH splash10-00di-3910000000-f681be35cf1016415c5f
Source of Spectrum DigiLab GmbH (C) 2024
Synonyms 3-methylbutyl 2-hydroxybenzoate
Technique GC/MS
Wiley ID DD2024_018182