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(E)-3-(2-Chlorophenyl)-1-{4-[(4-phenylphthalazin-1-yl)amino]-phenyl}prop-2-en-1-one
SpectraBase Compound ID 8W4K60Q9dTz
InChI InChI=1S/C29H20ClN3O/c30-26-13-7-4-8-20(26)16-19-27(34)21-14-17-23(18-15-21)31-29-25-12-6-5-11-24(25)28(32-33-29)22-9-2-1-3-10-22/h1-19H,(H,31,33)/b19-16+
InChIKey WSQPWZYFBVQQII-KNTRCKAVSA-N
Mol Weight 461.95 g/mol
Molecular Formula C29H20ClN3O
Exact Mass 461.12949 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 3bwC63AWaMF
Name (E)-3-(2-Chlorophenyl)-1-{4-[(4-phenylphthalazin-1-yl)amino]-phenyl}prop-2-en-1-one
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C29H20ClN3O
InChI InChI=1S/C29H20ClN3O/c30-26-13-7-4-8-20(26)16-19-27(34)21-14-17-23(18-15-21)31-29-25-12-6-5-11-24(25)28(32-33-29)22-9-2-1-3-10-22/h1-19H,(H,31,33)/b19-16+
InChIKey WSQPWZYFBVQQII-KNTRCKAVSA-N
Instrument Name Thermo Scientific GCMS
Ionization Type EI
Literature Reference DOI 10.1002/ardp.202100201
Molecular Weight 461.952 g/mol
SMILES N(c1c2ccccc2c(nn1)-c1ccccc1)c1ccc(cc1)C(=O)\C=C\c1ccccc1Cl
SPLASH splash10-03di-0000900000-72288946d42ab763db00
Source of Spectrum APC-354-SM8-5b
Wiley ID 1851398