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2-Propyloctanoic acid
SpectraBase Compound ID D7zXj9F7LpB
InChI InChI=1S/C11H22O2/c1-3-5-6-7-9-10(8-4-2)11(12)13/h10H,3-9H2,1-2H3,(H,12,13)
InChIKey YCYMCMYLORLIJX-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 GmiHhK9DSLv
Name 2-Propyloctanoic acid
CAS Registry Number 31080-41-8
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C11H22O2
InChI InChI=1S/C11H22O2/c1-3-5-6-7-9-10(8-4-2)11(12)13/h10H,3-9H2,1-2H3,(H,12,13)
InChIKey YCYMCMYLORLIJX-UHFFFAOYSA-N
Molecular Weight 186.295 g/mol
SMILES OC(=O)C(CCCCCC)CCC
SPLASH splash10-0fkc-9300000000-b1002a4258da45e74586
Source of Spectrum NP-3-3364-0
Wiley ID 1102558