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1,3-Propanedione, 2-(3-oxo-1(3H)-isobenzofuranylidene)-1,3-diphenyl-
SpectraBase Compound ID CegXYB4iUhn
InChI InChI=1S/C23H14O4/c24-20(15-9-3-1-4-10-15)19(21(25)16-11-5-2-6-12-16)22-17-13-7-8-14-18(17)23(26)27-22/h1-14H
InChIKey IORVCDPIWAFXFL-UHFFFAOYSA-N
Mol Weight 354.36 g/mol
Molecular Formula C23H14O4
Exact Mass 354.089209 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 8u1UePYGK7v
Name 1,3-Propanedione, 2-(3-oxo-1(3H)-isobenzofuranylidene)-1,3-diphenyl-
Alternate Name(s) 2-(3-oxo-2-benzofuran-1(3H)-ylidene)-1,3-diphenyl-1,3-propanedione 3-(Dibenzoylmethylene)phthalide Phthalide, 3-(dibenzoylmethylene)-
CAS Registry Number 7706-76-5
Comments Less than 3 mono-isotopic peaks
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C23H14O4
InChI InChI=1S/C23H14O4/c24-20(15-9-3-1-4-10-15)19(21(25)16-11-5-2-6-12-16)22-17-13-7-8-14-18(17)23(26)27-22/h1-14H
InChIKey IORVCDPIWAFXFL-UHFFFAOYSA-N
Molecular Weight 354.361 g/mol
SMILES C(=C1OC(=O)c2c1cccc2)(C(=O)c1ccccc1)C(=O)c1ccccc1
SPLASH splash10-0a4i-0902000000-a5bff46b71c26fced95c
Source of Spectrum KC-1978-1036-0
Wiley ID 1344928