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Amyl salicylate
SpectraBase Compound ID 4CoWB7Woins
InChI InChI=1S/C12H16O3/c1-2-3-6-9-15-12(14)10-7-4-5-8-11(10)13/h4-5,7-8,13H,2-3,6,9H2,1H3
InChIKey RANVDUNFZBMTBK-UHFFFAOYSA-N
Mol Weight 208.26 g/mol
Molecular Formula C12H16O3
Exact Mass 208.109944 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID B01wUABJaGu
Name Pentyl salicylate
CAS Registry Number 2050-08-0
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C12H16O3
GC Column J&W DB-5 (30 m x 0.25 mm ID x 0.25 ??m film thickness)
GC Oven Program 60 ??C to 246 ??C at 3 ??C/min.
InChI InChI=1S/C12H16O3/c1-2-3-6-9-15-12(14)10-7-4-5-8-11(10)13/h4-5,7-8,13H,2-3,6,9H2,1H3
InChIKey RANVDUNFZBMTBK-UHFFFAOYSA-N
Molecular Weight 208.257 g/mol
SMILES Oc1c(C(OCCCCC)=O)cccc1
SPLASH splash10-00di-5900000000-2ea8f5c5ad14d3186bc1
Source of Spectrum Adams' Essential Oil Components (GC-MS), Version 4
Wiley ID 1886842