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1,3-Diphenyl-3,4,6,7,8,8a-hexahydro-1H-isochromene
SpectraBase Compound ID Kzi876Z0XnV
InChI InChI=1S/C21H22O/c1-3-9-16(10-4-1)20-15-18-13-7-8-14-19(18)21(22-20)17-11-5-2-6-12-17/h1-6,9-13,19-21H,7-8,14-15H2
InChIKey SBMCIZSQQYXSHM-UHFFFAOYSA-N
Mol Weight 290.41 g/mol
Molecular Formula C21H22O
Exact Mass 290.167065 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID A2NtvpipOjD
Name 1,3-Diphenyl-3,4,6,7,8,8a-hexahydro-1H-isochromene
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C21H22O
InChI InChI=1S/C21H22O/c1-3-9-16(10-4-1)20-15-18-13-7-8-14-19(18)21(22-20)17-11-5-2-6-12-17/h1-6,9-13,19-21H,7-8,14-15H2
InChIKey SBMCIZSQQYXSHM-UHFFFAOYSA-N
Molecular Weight 290.406 g/mol
SMILES C1(OC(CC2=CCCCC12)c1ccccc1)c1ccccc1
SPLASH splash10-000x-1900000000-634efcb32dc4a5a6b1c8
Source of Spectrum C5-2002-939-1
Synonyms 1,3-Diphenyl-3,4,6,7,8,8a-hexahydro-1H-2-benzopyran
Wiley ID 1614610