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Butanoic acid, 2-methyl-, 3-methylbutyl ester
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 Cvx9lFrniXh
Name BUTANOIC ACID, 2-METHYL-, 3-METHYLBUTYL ESTER
Copyright Database Compilation Copyright © 2023-2024 John Wiley and Sons, Inc. Copyright © 2023-2024 John Wiley and Sons, Inc., Portions Copyright Wiley-VCH GmbH, Adams Library under license from Diablo Analytical. All Rights Reserved.
Exact Mass 172.146329882 u
Formula C10H20O2
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
Nominal Mass 172 u
Number of Peaks 41
SMILES CCC(C(OCCC(C)C)=O)C
SPLASH splash10-05fu-9000000000-4f0e0a5c3713d83ca30e
Source of Spectrum Chemical Concepts, A Wiley Division, Weinheim, Germany
Wiley ID MVX001072