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Decanoic acid isopropyl ester

View entire compound with spectra: 1 NMR, and 6 MS (GC)

Decanoic acid isopropyl ester
SpectraBase Compound ID J4nLE9pfMUv
InChI InChI=1S/C13H26O2/c1-4-5-6-7-8-9-10-11-13(14)15-12(2)3/h12H,4-11H2,1-3H3
InChIKey PKPPDYGHKDIKBH-UHFFFAOYSA-N
Mol Weight 214.35 g/mol
Molecular Formula C13H26O2
Exact Mass 214.19328 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID LgSalT0KDCY
Name n-Capric acid isopropyl ester
CAS Registry Number 2311-59-3
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C13H26O2
InChI InChI=1S/C13H26O2/c1-4-5-6-7-8-9-10-11-13(14)15-12(2)3/h12H,4-11H2,1-3H3
InChIKey PKPPDYGHKDIKBH-UHFFFAOYSA-N
Molecular Weight 214.349 g/mol
SMILES C(=O)(CCCCCCCCC)OC(C)C
SPLASH splash10-0006-9000000000-7fcfe0367237ae576531
Synonyms capric acid isopropyl ester decanoic acid propan-2-yl ester Decanoic acid, 1-methylethyl ester Isopropyl decanoate Propan-2-yl decanoate
Wiley ID 1492690