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5,6-Bis(1'-phenyl-1'-propen-3'-yl)-1,3-benzodioxole
SpectraBase Compound ID 5qURaaLYIRT
InChI InChI=1S/C25H22O2/c1-3-9-20(10-4-1)13-7-15-22-17-24-25(27-19-26-24)18-23(22)16-8-14-21-11-5-2-6-12-21/h1-14,17-18H,15-16,19H2/b13-7+,14-8+
InChIKey VLRWGSSRYDZZAQ-FNCQTZNRSA-N
Mol Weight 354.45 g/mol
Molecular Formula C25H22O2
Exact Mass 354.16198 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID Isc84TnOsEq
Name 5,6-Bis(1'-phenyl-1'-propen-3'-yl)-1,3-benzodioxole
Comments Less than 3 mono-isotopic peaks
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C25H22O2
InChI InChI=1S/C25H22O2/c1-3-9-20(10-4-1)13-7-15-22-17-24-25(27-19-26-24)18-23(22)16-8-14-21-11-5-2-6-12-21/h1-14,17-18H,15-16,19H2/b13-7+,14-8+
InChIKey VLRWGSSRYDZZAQ-FNCQTZNRSA-N
Molecular Weight 354.449 g/mol
SMILES c12c(cc(c(c2)C\C=C\c2ccccc2)C\C=C\c2ccccc2)OCO1
SPLASH splash10-0udi-0097000000-b53b49077186658f2cfd
Source of Spectrum J-64-2761-51
Synonyms 5,6-bis[(2E)-3-phenyl-2-propenyl]-1,3-benzodioxole
Wiley ID 1529943