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2,7-Diamino-4-(4-chlorophenyl)-4H-benzo[h]chromene-3-carboxylic acid ethyl ester

View entire compound with spectra: 1 MS (GC)

2,7-Diamino-4-(4-chlorophenyl)-4H-benzo[h]chromene-3-carboxylic acid ethyl ester
SpectraBase Compound ID 3eAVQEUCw4y
InChI InChI=1S/C22H19ClN2O3/c1-2-27-22(26)19-18(12-6-8-13(23)9-7-12)16-11-10-14-15(4-3-5-17(14)24)20(16)28-21(19)25/h3-11,18H,2,24-25H2,1H3
InChIKey OLAKQJDUYISPOU-UHFFFAOYSA-N
Mol Weight 394.86 g/mol
Molecular Formula C22H19ClN2O3
Exact Mass 394.10842 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID wzan3bxRdu
Name 2,7-Diamino-4-(4-chlorophenyl)-4H-benzo[h]chromene-3-carboxylic acid ethyl ester
Alternate Name(s) 2,7-Diamino-4-(4-chlorophenyl)-4H-benzo[h][1]benzopyran-3-carboxylic acid ethyl ester Ethyl 2,7-bis(azanyl)-4-(4-chlorophenyl)-4H-benzo[h]chromene-3-carboxylate Ethyl 2,7-diamino-4-(4-chlorophenyl)-4H-benzo[h]chromene-3-carboxylate
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C22H19ClN2O3
InChI InChI=1S/C22H19ClN2O3/c1-2-27-22(26)19-18(12-6-8-13(23)9-7-12)16-11-10-14-15(4-3-5-17(14)24)20(16)28-21(19)25/h3-11,18H,2,24-25H2,1H3
InChIKey OLAKQJDUYISPOU-UHFFFAOYSA-N
Molecular Weight 394.858 g/mol
SMILES Nc1cccc2c3c(C(C(=C(O3)N)C(=O)OCC)c3ccc(cc3)Cl)ccc12
SPLASH splash10-001i-0192000000-e3a5b5f88dc07c18cd3e
Source of Spectrum O1-63-1802-3
Wiley ID 1592784