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3-Phenyl-1H,3H-benzo[de]isochromen-1-one
SpectraBase Compound ID 8mHXvm0wWvW
InChI InChI=1S/C18H12O2/c19-18-15-11-5-9-12-8-4-10-14(16(12)15)17(20-18)13-6-2-1-3-7-13/h1-11,17H
InChIKey LAXYIIUGSPTWEY-UHFFFAOYSA-N
Mol Weight 260.29 g/mol
Molecular Formula C18H12O2
Exact Mass 260.08373 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID LjjKGpsh30Q
Name 3-Phenyl-1H,3H-benzo[de]isochromen-1-one
Alternate Name(s) 3-Phenylnaphthalide 3-phenyl-1H,3H-naphtho[1,8-cd]pyran-1-one
CAS Registry Number 69517-55-1
Comments Less than 3 mono-isotopic peaks
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C18H12O2
InChI InChI=1S/C18H12O2/c19-18-15-11-5-9-12-8-4-10-14(16(12)15)17(20-18)13-6-2-1-3-7-13/h1-11,17H
InChIKey LAXYIIUGSPTWEY-UHFFFAOYSA-N
Molecular Weight 260.292 g/mol
SMILES C1(OC(c2c3c(cccc13)ccc2)c1ccccc1)=O
SPLASH splash10-000i-9030000000-9b8dc9284c1a61e98c17
Source of Spectrum KC-0-1383-5
Wiley ID 830541