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Dodecanoic acid, isopentyl ester
SpectraBase Compound ID ADo9L8XH8rL
InChI InChI=1S/C17H34O2/c1-4-5-6-7-8-9-10-11-12-13-17(18)19-15-14-16(2)3/h16H,4-15H2,1-3H3
InChIKey FVKRIDSRWFEQME-UHFFFAOYSA-N
Mol Weight 270.5 g/mol
Molecular Formula C17H34O2
Exact Mass 270.25588 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 4pn7PXVAyO
Name Isoamyl dodecanoate
CAS Registry Number 6309-51-9
Copyright Database Compilation Copyright © 2023-2024 John Wiley and Sons, Inc. Copyright © 2023-2024 John Wiley and Sons, Inc., Portions Copyright Wiley-VCH GmbH, Adams Library under license from Diablo Analytical. All Rights Reserved.
Exact Mass 270.255880333 u
Formula C17H34O2
GC Column J&W DB-5 (30 m x 0.25 mm ID x 0.25 μm film thickness)
GC Oven Program 60 °C to 246 °C at 3 °C/min.
InChI InChI=1S/C17H34O2/c1-4-5-6-7-8-9-10-11-12-13-17(18)19-15-14-16(2)3/h16H,4-15H2,1-3H3
InChIKey FVKRIDSRWFEQME-UHFFFAOYSA-N
Molecular Weight 270.457 g/mol
Nominal Mass 270 u
Number of Peaks 147
SMILES C(OCCC(C)C)(=O)CCCCCCCCCCC
SPLASH splash10-00dl-9000000000-a443c9a5ab0176e49129
Source of Spectrum Adams' Essential Oil Components (GC-MS), Version 4
Wiley ID RA001771