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Heptanoic acid, 2-propyl-, methyl ester
SpectraBase Compound ID 7LpTZSJiAlR
InChI InChI=1S/C11H22O2/c1-4-6-7-9-10(8-5-2)11(12)13-3/h10H,4-9H2,1-3H3
InChIKey IWCYIKHCWOSDAM-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 KfHYvNNulni
Name Heptanoic acid, 2-propyl-, methyl ester
Alternate Name(s) Methyl 2-propylheptanoate 2-Propylenanthic acid methyl ester 2-Propylheptanoic acid methyl ester
CAS Registry Number 56247-53-1
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C11H22O2
InChI InChI=1S/C11H22O2/c1-4-6-7-9-10(8-5-2)11(12)13-3/h10H,4-9H2,1-3H3
InChIKey IWCYIKHCWOSDAM-UHFFFAOYSA-N
Molecular Weight 186.295 g/mol
SMILES C(C(C(OC)=O)CCC)CCCC
SPLASH splash10-000i-9400000000-f46d8a7a2693b20be30b
Source of Spectrum W5-1989-65123-413
Wiley ID 1183077