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1-Oxo-2-phenyl-1H-inden-3-yl 3-nitrobenzoate
SpectraBase Compound ID IqEMPrH0pmw
InChI InChI=1S/C22H13NO5/c24-20-17-11-4-5-12-18(17)21(19(20)14-7-2-1-3-8-14)28-22(25)15-9-6-10-16(13-15)23(26)27/h1-13H
InChIKey QHUNSTFNXSLQAH-UHFFFAOYSA-N
Mol Weight 371.35 g/mol
Molecular Formula C22H13NO5
Exact Mass 371.079373 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID ERjcI7tHTQB
Name 1-Oxo-2-phenyl-1H-inden-3-yl 3-nitrobenzoate
CAS Registry Number 97586-15-7
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C22H13NO5
InChI InChI=1S/C22H13NO5/c24-20-17-11-4-5-12-18(17)21(19(20)14-7-2-1-3-8-14)28-22(25)15-9-6-10-16(13-15)23(26)27/h1-13H
InChIKey QHUNSTFNXSLQAH-UHFFFAOYSA-N
Molecular Weight 371.348 g/mol
SMILES C1(=C(C(=O)c2c1cccc2)c1ccccc1)OC(c1cc(N(=O)=O)ccc1)=O
SPLASH splash10-0udi-3900000000-131794f8e4c8b702f99e
Source of Spectrum AD-0-2532-0
Synonyms (3-oxidanylidene-2-phenyl-inden-1-yl) 3-nitrobenzoate (3-oxo-2-phenyl-inden-1-yl) 3-nitrobenzoate 1H-Inden-1-one, 3-[(3-nitrobenzoyl)oxy]-2-phenyl- 3-Nitrobenzoic acid (3-keto-2-phenyl-inden-1-yl) ester 3-Nitrobenzoic acid (3-oxo-2-phenyl-1-indenyl) ester Benzoic acid, 3-nitro-, 1-oxo-2-phenylinden-3-yl ester
Wiley ID 1419512