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Isobutyl salicylate
SpectraBase Compound ID JDNJRy6LgfM
InChI InChI=1S/C11H14O3/c1-8(2)7-14-11(13)9-5-3-4-6-10(9)12/h3-6,8,12H,7H2,1-2H3
InChIKey PTXDBYSCVQQBNF-UHFFFAOYSA-N
Mol Weight 194.23 g/mol
Molecular Formula C11H14O3
Exact Mass 194.094294 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID FyoKufhCuI4
Name Benzoic acid, 2-hydroxy-, 2-methylpropyl ester
CAS Registry Number 87-19-4
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C11H14O3
InChI InChI=1S/C11H14O3/c1-8(2)7-14-11(13)9-5-3-4-6-10(9)12/h3-6,8,12H,7H2,1-2H3
InChIKey PTXDBYSCVQQBNF-UHFFFAOYSA-N
Molecular Weight 194.230 g/mol
SMILES Oc1c(C(OCC(C)C)=O)cccc1
SPLASH splash10-00di-9800000000-cba9eb980ed2aa32cbcf
Source of Spectrum AA-0-1353-2
Synonyms 2-Hydroxybenzoic acid 2-methylpropyl ester 2-Hydroxybenzoic acid isobutyl ester 2-Isobutoxycarbonylphenol 2-Methyl-1-propyl salicylate 2-Methylpropyl 2-hydroxybenzoate 2-Methylpropyl salicylate 2-Methylpropyl 2-oxidanylbenzoate 2-Methylpropyl o-hydroxybenzoate iso-Butyl salicylate isobutyl 2-hydroxybenzoate Isobutyl o-hydroxybenzoate Orchindone Salicylic acid, isobutyl ester AI3-24370 BRN 2615955 EINECS 201-729-9 FEMA NO. 2213 NSC 62140
Wiley ID 74598