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2- Methylbutyl 2-methylbutyrate
SpectraBase Compound ID 6m7k1O1OXnx
InChI InChI=1S/C10H20O2/c1-5-8(3)7-12-10(11)9(4)6-2/h8-9H,5-7H2,1-4H3
InChIKey PVYFCGRBIREQLL-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 D2rje9n036
Name Butanoic acid, 2-methyl-, 2-methylbutyl ester
CAS Registry Number 2445-78-5
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C10H20O2
InChI InChI=1S/C10H20O2/c1-5-8(3)7-12-10(11)9(4)6-2/h8-9H,5-7H2,1-4H3
InChIKey PVYFCGRBIREQLL-UHFFFAOYSA-N
Molecular Weight 172.268 g/mol
SMILES CCC(C(=O)OCC(CC)C)C
SPLASH splash10-0adu-9000000000-740b8adfc919b095b901
Source of Spectrum VC-1981-572-0
Synonyms Butyric acid, 2-methyl-, 2-methylbutyl ester 2-Methylbutanoic acid 2-methylbutyl ester 2-Methylbutyl 2-methylbutanoate 2-Methylbutyl 2-methylbutyrate 2-Methylbutyric acid 2-methylbutyl ester dl-2-Methylbutyric acid 2-methylbutyl ester EINECS 219-497-2 FEMA NO. 3359
Wiley ID 1169042