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(4-methoxyhepta-1,2-dien-6-yn-4-yl)benzene
SpectraBase Compound ID H4VLvDTbjzt
InChI InChI=1S/C14H14O/c1-4-11-14(15-3,12-5-2)13-9-7-6-8-10-13/h1,6-10,12H,2,11H2,3H3
InChIKey JGXPKIOQLASZHR-UHFFFAOYSA-N
Mol Weight 198.26 g/mol
Molecular Formula C14H14O
Exact Mass 198.104465 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID EimDTohNZDJ
Name (4-methoxyhepta-1,2-dien-6-yn-4-yl)benzene
Comments Removed - expert review: contamination (CDCl3); A corrected record has been addded having SpectrumID: 1821322
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C14H14O
InChI InChI=1S/C14H14O/c1-4-11-14(15-3,12-5-2)13-9-7-6-8-10-13/h1,6-10,12H,2,11H2,3H3
InChIKey JGXPKIOQLASZHR-UHFFFAOYSA-N
Literature Reference DOI 10.1002/asia.201000267
Molecular Weight 198.265 g/mol
SMILES c1(C(CC#C)(OC)C=C=C)ccccc1
SPLASH splash10-057r-9400000000-79621706fa5c83d75a03
Source of Spectrum CAJ-5-2218-8
Wiley ID 1772966