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Butyric acid isobutyl ester
SpectraBase Compound ID 4NqdOBFZdeh
InChI InChI=1S/C8H16O2/c1-4-5-8(9)10-6-7(2)3/h7H,4-6H2,1-3H3
InChIKey RGFNRWTWDWVHDD-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 IPbRWz1iebs
Name Butanoic acid, 2-methylpropyl ester
Alternate Name(s) Butyric acid, isobutyl ester 2-Methyl-1-propyl butyrate 2-Methylpropyl butanoate 2-Methylpropyl butyrate Isobutyl butanoate Isobutyl butyrate Isobutyl ester of butanoic acid Isobutyl n-butyrate n-Butyric acid isobutyl ester Butanoic acid 2-methylpropyl ester AI3-11267 BRN 1747322 EINECS 208-729-8 FEMA NO. 2187 NSC 406938
CAS Registry Number 539-90-2
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Formula C8H16O2
InChI InChI=1S/C8H16O2/c1-4-5-8(9)10-6-7(2)3/h7H,4-6H2,1-3H3
InChIKey RGFNRWTWDWVHDD-UHFFFAOYSA-N
Molecular Weight 144.214 g/mol
SMILES C(OCC(C)C)(CCC)=O
SPLASH splash10-0596-9000000000-aa6923dbf06001c6e357
Source of Spectrum UT-1990-1729-0
Wiley ID 1142687