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3-(p-Tolyl)-1H-isochromen-1-one
SpectraBase Compound ID R6325IIJa0
InChI InChI=1S/C16H12O2/c1-11-6-8-12(9-7-11)15-10-13-4-2-3-5-14(13)16(17)18-15/h2-10H,1H3
InChIKey FDFPICMLMJIYNM-UHFFFAOYSA-N
Mol Weight 236.27 g/mol
Molecular Formula C16H12O2
Exact Mass 236.08373 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 7G61PcfBIMk
Name 3-(p-Tolyl)-1H-isochromen-1-one
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C16H12O2
InChI InChI=1S/C16H12O2/c1-11-6-8-12(9-7-11)15-10-13-4-2-3-5-14(13)16(17)18-15/h2-10H,1H3
InChIKey FDFPICMLMJIYNM-UHFFFAOYSA-N
Literature Reference DOI 10.1021/jo300501j
Molecular Weight 236.270 g/mol
SMILES c1ccc2C=C(OC(=O)c2c1)c1ccc(cc1)C
SPLASH splash10-052r-0190000000-06642384e00f0915e278
Source of Spectrum J-77-5027-3n
Synonyms 3-(4-Methylphenyl)-2-benzopyran-1-one 3-(p-tolyl)isochromen-1-one 3-(4-Methylphenyl)isochromen-1-one
Wiley ID 1745116