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11-hexadecynyl acetate

View entire compound with spectra: 1 MS (GC)

11-hexadecynyl acetate
SpectraBase Compound ID 7DzFFvP689m
InChI InChI=1S/C18H32O2/c1-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-20-18(2)19/h3-5,8-17H2,1-2H3
InChIKey CGNKNPUOEKFUNR-UHFFFAOYSA-N
Mol Weight 280.5 g/mol
Molecular Formula C18H32O2
Exact Mass 280.24023 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 96y2cS0dYwK
Name 11-hexadecynyl acetate
CAS Registry Number 53596-80-8
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C18H32O2
InChI InChI=1S/C18H32O2/c1-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-20-18(2)19/h3-5,8-17H2,1-2H3
InChIKey CGNKNPUOEKFUNR-UHFFFAOYSA-N
Molecular Weight 280.452 g/mol
SMILES C(#CCCCC)CCCCCCCCCCOC(=O)C
SPLASH splash10-0006-9030000000-fd6c941576e51c0bb967
Source of Spectrum I-55-4142-0
Synonyms Acetic acid hexadec-11-ynyl ester Hexadec-11-ynyl acetate Hexadec-11-ynyl ethanoate
Wiley ID 1284330