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Butanoic acid, 3-methyl-, 1-methylethyl ester
SpectraBase Compound ID 6Bc7kbTmhe2
InChI InChI=1S/C8H16O2/c1-6(2)5-8(9)10-7(3)4/h6-7H,5H2,1-4H3
InChIKey ZOIRKXLFEHOVER-UHFFFAOYSA-N
Mol Weight 144.21 g/mol
Molecular Formula C8H16O2
Exact Mass 144.11503 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 9essNY4dHZw
Name Butanoic acid, 3-methyl-, 1-methylethyl ester
CAS Registry Number 32665-23-9
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C8H16O2
InChI InChI=1S/C8H16O2/c1-6(2)5-8(9)10-7(3)4/h6-7H,5H2,1-4H3
InChIKey ZOIRKXLFEHOVER-UHFFFAOYSA-N
Molecular Weight 144.214 g/mol
SMILES C(=O)(OC(C)C)CC(C)C
SPLASH splash10-052o-9100000000-bd9e26230d85ae3d7a2a
Source of Spectrum LQ-1992-1588-0
Synonyms 1-Methylethyl 3-methylbutanoate Isovaleric acid, isopropyl ester Isopropyl 3-methylbutanoate 3-Methylbutanoic acid propan-2-yl ester 3-Methylbutyric acid isopropyl ester iso-Propyl iso-valerate Isopropyl 3-methylbutyrate Isopropyl isopentanoate Isopropyl isovalianate Propan-2-yl 3-methylbutanoate AI3-33617 EINECS 251-145-3 FEMA NO. 2961
Wiley ID 1142820