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Octanoic acid, pent-2-en-4-ynyl ester

View entire compound with spectra: 1 MS (GC)

Octanoic acid, pent-2-en-4-ynyl ester
SpectraBase Compound ID Gi6LZZ3yE9i
InChI InChI=1S/C13H20O2/c1-3-5-7-8-9-11-13(14)15-12-10-6-4-2/h2,6,10H,3,5,7-9,11-12H2,1H3
InChIKey QSUKOVORNGWCOD-UHFFFAOYSA-N
Mol Weight 208.3 g/mol
Molecular Formula C13H20O2
Exact Mass 208.14633 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID GwBUdtmkVVb
Name Octanoic acid, pent-2-en-4-ynyl ester
Alternate Name(s) Octanoic acid pent-2-en-4-ynyl ester Pent-2-en-4-ynyl octanoate
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C13H20O2
InChI InChI=1S/C13H20O2/c1-3-5-7-8-9-11-13(14)15-12-10-6-4-2/h2,6,10H,3,5,7-9,11-12H2,1H3
InChIKey QSUKOVORNGWCOD-UHFFFAOYSA-N
Molecular Weight 208.301 g/mol
SMILES CCCCCCCC(=O)OCC=CC#C
SPLASH splash10-0a6r-9300000000-4429559e73977ddcfb3c
Source of Spectrum NP-4-5924-0
Wiley ID 1104072