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(R,S)-N-{4-[3-(2,6-Dichlorophenyl)-4,5-dihydro-1H-pyrazol-5-yl]phenyl}-4-phenylphthalazin-1-amine
SpectraBase Compound ID 9EzTQTAiiPs
InChI InChI=1S/C29H21Cl2N5/c30-23-11-6-12-24(31)27(23)26-17-25(33-34-26)18-13-15-20(16-14-18)32-29-22-10-5-4-9-21(22)28(35-36-29)19-7-2-1-3-8-19/h1-16,26,34H,17H2,(H,32,36)
InChIKey VVHJTVIVGDPDEK-UHFFFAOYSA-N
Mol Weight 510.43 g/mol
Molecular Formula C29H21Cl2N5
Exact Mass 509.117401 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID J8dzqaDz8hh
Name (R,S)-N-{4-[3-(2,6-Dichlorophenyl)-4,5-dihydro-1H-pyrazol-5-yl]phenyl}-4-phenylphthalazin-1-amine
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C29H21Cl2N5
InChI InChI=1S/C29H21Cl2N5/c30-23-11-6-12-24(31)27(23)26-17-25(33-34-26)18-13-15-20(16-14-18)32-29-22-10-5-4-9-21(22)28(35-36-29)19-7-2-1-3-8-19/h1-16,26,34H,17H2,(H,32,36)
InChIKey VVHJTVIVGDPDEK-UHFFFAOYSA-N
Instrument Name Thermo Scientific GCMS
Ionization Type EI
Literature Reference DOI 10.1002/ardp.202100201
Molecular Weight 510.428 g/mol
SMILES N(c1c2ccccc2c(nn1)-c1ccccc1)c1ccc(C2=NNC(C2)c2c(cccc2Cl)Cl)cc1
SPLASH splash10-004i-9437530000-58d58f287d6ae11f1a1a
Source of Spectrum APC-354-SM25-6d
Wiley ID 1851402