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(phenylmethyl) 3-nitro-4-oxidanylidene-quinoline-1-carboxylate
SpectraBase Compound ID 34XIPwieyEb
InChI InChI=1S/C17H12N2O5/c20-16-13-8-4-5-9-14(13)18(10-15(16)19(22)23)17(21)24-11-12-6-2-1-3-7-12/h1-10H,11H2
InChIKey CDLVCPPVGQQMFR-UHFFFAOYSA-N
Mol Weight 324.29 g/mol
Molecular Formula C17H12N2O5
Exact Mass 324.074621 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID BGpJVYvziJs
Name (phenylmethyl) 3-nitro-4-oxidanylidene-quinoline-1-carboxylate
CAS Registry Number 125836-11-5
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C17H12N2O5
InChI InChI=1S/C17H12N2O5/c20-16-13-8-4-5-9-14(13)18(10-15(16)19(22)23)17(21)24-11-12-6-2-1-3-7-12/h1-10H,11H2
InChIKey CDLVCPPVGQQMFR-UHFFFAOYSA-N
Molecular Weight 324.292 g/mol
SMILES C1(N(=O)=O)=CN(C(OCc2ccccc2)=O)c2c(C1=O)cccc2
SPLASH splash10-0006-9000000000-7accb5cf381ab212b1ba
Source of Spectrum F-45-900-5
Synonyms 3-Nitro-4-oxo-1-quinolinecarboxylic acid (phenylmethyl) ester 4-keto-3-nitro-quinoline-1-carboxylic acid benzyl ester benzyl 3-nitro-4-oxo-quinoline-1-carboxylate
Wiley ID 1323062