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Octanoic acid, 2-butyl-

View entire compound with spectra: 1 FTIR, and 4 MS (GC)

Octanoic acid, 2-butyl-
SpectraBase Compound ID 7svdNYQhINt
InChI InChI=1S/C12H24O2/c1-3-5-7-8-10-11(12(13)14)9-6-4-2/h11H,3-10H2,1-2H3,(H,13,14)
InChIKey OARDBPIZDHVTCK-UHFFFAOYSA-N
Mol Weight 200.32 g/mol
Molecular Formula C12H24O2
Exact Mass 200.17763 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID A51My741WG5
Name Octanoic acid, 2-butyl-
Alternate Name(s) 2-Butylcaprylic acid 2-Butyloctanoic acid 2-Butyloctansaeure 5-Undecanecarboxylic acid BRN 1765736 EINECS 248-570-1
CAS Registry Number 27610-92-0
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C12H24O2
InChI InChI=1S/C12H24O2/c1-3-5-7-8-10-11(12(13)14)9-6-4-2/h11H,3-10H2,1-2H3,(H,13,14)
InChIKey OARDBPIZDHVTCK-UHFFFAOYSA-N
Molecular Weight 200.322 g/mol
SMILES OC(C(CCCCCC)CCCC)=O
SPLASH splash10-00fu-9200000000-ab83197e58cc6e6a601c
Wiley ID 1493717