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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 3EhQA7RJoLY
Name 2-Methylbutyl isovalerate
Alternate Name(s) Methyl butyl isovalerate<2->
CAS Registry Number 2445-77-4
Copyright Copyright © 2020-2024 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)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 C(OCC(CC)C)(CC(C)C)=O
SPLASH splash10-059f-9000000000-5b9fd23ee7d56e8f2427
Source ex ALDRICH
Source of Spectrum Adams' Essential Oil Components (GC-MS), Version 4
Wiley ID 1887632