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1-((1E,4Z)-hepta-1,4-dien-1-yl)-3-isopropoxybenzene
SpectraBase Compound ID EMaz8qKt6Dk
InChI InChI=1S/C16H22O/c1-4-5-6-7-8-10-15-11-9-12-16(13-15)17-14(2)3/h5-6,8-14H,4,7H2,1-3H3/b6-5-,10-8+
InChIKey SJHOSAKFUQGIPU-UGXDAERVSA-N
Mol Weight 230.35 g/mol
Molecular Formula C16H22O
Exact Mass 230.167065 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID JwN3IZD4D40
Name 1-((1E,4Z)-hepta-1,4-dien-1-yl)-3-isopropoxybenzene
Appearance Colorless liquid
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C16H22O
InChI InChI=1S/C16H22O/c1-4-5-6-7-8-10-15-11-9-12-16(13-15)17-14(2)3/h5-6,8-14H,4,7H2,1-3H3/b6-5-,10-8+
InChIKey SJHOSAKFUQGIPU-UGXDAERVSA-N
Ionization Type EI
Molecular Weight 230.351 g/mol
SMILES C(\C=C\c1cc(ccc1)OC(C)C)\C=C/CC
SPLASH splash10-059t-1900000000-46c2dc26ad02ec8d9697
Source of Spectrum WO2020089274A1
Wiley ID 1877327