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Formic acid, octyl ester

View entire compound with spectra: 4 NMR, 4 FTIR, and 7 MS (GC)

Formic acid, octyl ester
SpectraBase Compound ID 6nACRt2Oqj5
InChI InChI=1S/C9H18O2/c1-2-3-4-5-6-7-8-11-9-10/h9H,2-8H2,1H3
InChIKey AVBRYQRTMPHARE-UHFFFAOYSA-N
Mol Weight 158.24 g/mol
Molecular Formula C9H18O2
Exact Mass 158.13068 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID AnXknHAdJXa
Name Octyl formate
Alternate Name(s) 1-Octyl formate formic acid octyl ester n-Octyl formate n-Octyl methanoate Octyl alcohol, formate Octyl methanoate BRN 1755259 EINECS 203-959-5 FEMA NO. 2809 NSC 404473
CAS Registry Number 112-32-3
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C9H18O2
InChI InChI=1S/C9H18O2/c1-2-3-4-5-6-7-8-11-9-10/h9H,2-8H2,1H3
InChIKey AVBRYQRTMPHARE-UHFFFAOYSA-N
Molecular Weight 158.241 g/mol
SMILES C(CCCCC)CCOC=O
SPLASH splash10-0a5c-9000000000-6d60d4bf84bc13fa2278
Source of Spectrum PR-624-0-0
Wiley ID 1155565