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Non-1-en-8-yn-3-yl Benzoate

View entire compound with spectra: 1 MS (GC)

Non-1-en-8-yn-3-yl Benzoate
SpectraBase Compound ID 1ip39CRs0kb
InChI InChI=1S/C16H18O2/c1-3-5-6-10-13-15(4-2)18-16(17)14-11-8-7-9-12-14/h1,4,7-9,11-12,15H,2,5-6,10,13H2
InChIKey PTNFGFZPNKGWPB-UHFFFAOYSA-N
Mol Weight 242.32 g/mol
Molecular Formula C16H18O2
Exact Mass 242.13068 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID KEYOwVpbEWI
Name Non-1-en-8-yn-3-yl Benzoate
Alternate Name(s) 1-Vinyl-6-heptynyl benzoate
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C16H18O2
InChI InChI=1S/C16H18O2/c1-3-5-6-10-13-15(4-2)18-16(17)14-11-8-7-9-12-14/h1,4,7-9,11-12,15H,2,5-6,10,13H2
InChIKey PTNFGFZPNKGWPB-UHFFFAOYSA-N
Molecular Weight 242.318 g/mol
SMILES C(OC(C=C)CCCCC#C)(=O)c1ccccc1
SPLASH splash10-0a6r-4900000000-d9c62af1aa7a8fd6f4d8
Source of Spectrum F-54-1068-9
Wiley ID 805634