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2-Hexyloctanoic acid
SpectraBase Compound ID 1xDDBCooeic
InChI InChI=1S/C14H28O2/c1-3-5-7-9-11-13(14(15)16)12-10-8-6-4-2/h13H,3-12H2,1-2H3,(H,15,16)/i7D
InChIKey SQPZLZZLAPHSPL-WHRKIXHSSA-N
Mol Weight 229.38 g/mol
Molecular Formula C14H27DO2
Exact Mass 229.215207 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID COINprGa1mA
Name 2-Hexyloctanoic acid
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C14H27DO2
InChI InChI=1S/C14H28O2/c1-3-5-7-9-11-13(14(15)16)12-10-8-6-4-2/h13H,3-12H2,1-2H3,(H,15,16)/i7D
InChIKey SQPZLZZLAPHSPL-WHRKIXHSSA-N
Molecular Weight 229.382 g/mol
SMILES OC(=O)C(CCC([D])CCC)CCCCCC
SPLASH splash10-0fdn-9600000000-0251a1ed5b4a664a92f3
Wiley ID 1489719