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3-Methylbutyl 2-methylbutanoate
SpectraBase Compound ID DIlf9mPdj8N
InChI InChI=1S/C10H20O2/c1-5-9(4)10(11)12-7-6-8(2)3/h8-9H,5-7H2,1-4H3
InChIKey VGIRHYHLQKDEPP-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 L34lTXVV44n
Name Isopentyl 2-methyl butanoate
CAS Registry Number 27625-35-0
Copyright Copyright © 2020-2025 John Wiley & Sons, Inc. All Rights Reserved.
Formula C10H20O2
GC Column J&W DB-5 (30 m x 0.25 mm ID x 0.25 ??m film thickness)
GC Oven Program 60 ??C to 246 ??C at 3 ??C/min.
InChI InChI=1S/C10H20O2/c1-5-9(4)10(11)12-7-6-8(2)3/h8-9H,5-7H2,1-4H3
InChIKey VGIRHYHLQKDEPP-UHFFFAOYSA-N
Molecular Weight 172.268 g/mol
SMILES CCC(C(OCCC(C)C)=O)C
SPLASH splash10-0596-9000000000-cc47144a289d096dd745
Source of Spectrum Adams' Essential Oil Components (GC-MS), Version 4
Wiley ID 1887550