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2-Methylbutyl isovalerate
SpectraBase Compound ID 3jfhItLB4vX
InChI InChI=1S/C10H20O2/c1-5-9(4)7-12-10(11)6-8(2)3/h8-9H,5-7H2,1-4H3
InChIKey CYGPPWVXOWCHJB-UHFFFAOYSA-N
Mol Weight 172.27 g/mol
Molecular Formula C10H20O2
Exact Mass 172.14633 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID Bhv1CB8UqIF
Name Butanoic acid, 3-methyl-, 2-methylbutyl ester
Alternate Name(s) Isovaleric acid, 2-methylbutyl ester 2-Methylbutyl isopentanoate 2-Methylbutyl 3-methylbutanoate 2-Methylbutyl 3-methylbutyrate 2-Methylbutyl isovalerate 2-Methylbutyl isovalerianate 3-Methylbutanoic acid 2-methylbutyl ester 3-Methylbutyric acid 2-methylbutyl ester 2-Methylbutyl-3-methyl butyrate AI3-33764 EINECS 219-496-7 FEMA NO. 3506
CAS Registry Number 2445-77-4
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Formula C10H20O2
InChI InChI=1S/C10H20O2/c1-5-9(4)7-12-10(11)6-8(2)3/h8-9H,5-7H2,1-4H3
InChIKey CYGPPWVXOWCHJB-UHFFFAOYSA-N
Molecular Weight 172.268 g/mol
SMILES CCC(C)COC(=O)CC(C)C
SPLASH splash10-060c-9000000000-9283694e07521cc2e252
Source of Spectrum AA-0-1156-2
Wiley ID 16187