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3,4-Diphenyl-1H-benzo[h]isochromen-1-one
SpectraBase Compound ID 8ToIjPzyxMf
InChI InChI=1S/C25H16O2/c26-25-23-20-14-8-7-9-17(20)15-16-21(23)22(18-10-3-1-4-11-18)24(27-25)19-12-5-2-6-13-19/h1-16H
InChIKey VYWUMAACTDTIQY-UHFFFAOYSA-N
Mol Weight 348.4 g/mol
Molecular Formula C25H16O2
Exact Mass 348.11503 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 1UQB1k24zyD
Name 3,4-Diphenyl-1H-benzo[h]isochromen-1-one
Alternate Name(s) 3,4-Diphenyl-1-benzo[h][2]benzopyranone 3,4-Diphenylbenzo[h]isochromen-1-one
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C25H16O2
InChI InChI=1S/C25H16O2/c26-25-23-20-14-8-7-9-17(20)15-16-21(23)22(18-10-3-1-4-11-18)24(27-25)19-12-5-2-6-13-19/h1-16H
InChIKey VYWUMAACTDTIQY-UHFFFAOYSA-N
Literature Reference DOI 10.1002/anie.201500600
Molecular Weight 348.401 g/mol
SMILES c1c2ccccc2c2c(C(=C(OC2=O)c2ccccc2)c2ccccc2)c1
SPLASH splash10-0002-4239000000-f58b65da94683ee8188f
Source of Spectrum ACI-54-5513/SMS53-3ia
Wiley ID 1761170