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3-Methylpentyl 3-methylbutanoate
SpectraBase Compound ID EPGavEnRYwA
InChI InChI=1S/C11H22O2/c1-5-9(3)7-8-13-11(12)10(4)6-2/h9-10H,5-8H2,1-4H3
InChIKey OGFNJVCHDZQOND-UHFFFAOYSA-N
Mol Weight 186.29 g/mol
Molecular Formula C11H22O2
Exact Mass 186.16198 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 6K1tkMq1y5M
Name 3-Methylpentyl 3-methylbutanoate
CAS Registry Number 83783-89-5
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C11H22O2
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/C11H22O2/c1-5-9(3)7-8-13-11(12)10(4)6-2/h9-10H,5-8H2,1-4H3
InChIKey OGFNJVCHDZQOND-UHFFFAOYSA-N
Molecular Weight 186.295 g/mol
SMILES C(C(C(OCCC(CC)C)=O)C)C
SPLASH splash10-052f-9100000000-b135916377910cb00d65
Source ex LOMATIUM DISSECTIUM ROOTS
Source of Spectrum Adams' Essential Oil Components (GC-MS), Version 4
Synonyms Butanoate<3-methylpentyl, 3-methyl->
Wiley ID 1885964