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2-(4,5-dihydro-5-phenyl-1-(4-phenylthiazol-2-yl)-1H-pyrazol-3-yl)-10H-phenothiazine
SpectraBase Compound ID 2P1KpFA19UH
InChI InChI=1S/C30H22N4S2/c1-3-9-20(10-4-1)26-19-35-30(32-26)34-27(21-11-5-2-6-12-21)18-24(33-34)22-15-16-29-25(17-22)31-23-13-7-8-14-28(23)36-29/h1-17,19,27,31H,18H2
InChIKey VGWMRTBEGZBGCW-UHFFFAOYSA-N
Mol Weight 502.65 g/mol
Molecular Formula C30H22N4S2
Exact Mass 502.128589 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 2kyk95rkG6R
Name 2-(4,5-dihydro-5-phenyl-1-(4-phenylthiazol-2-yl)-1H-pyrazol-3-yl)-10H-phenothiazine
Appearance Green crystals
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Formula C30H22N4S2
InChI InChI=1S/C30H22N4S2/c1-3-9-20(10-4-1)26-19-35-30(32-26)34-27(21-11-5-2-6-12-21)18-24(33-34)22-15-16-29-25(17-22)31-23-13-7-8-14-28(23)36-29/h1-17,19,27,31H,18H2
InChIKey VGWMRTBEGZBGCW-UHFFFAOYSA-N
Instrument Name Kratos MS equipment or Varian MAT 311A
Ionization Type EI
Literature Reference DOI 10.1002/jhet.2716
Molecular Weight 502.654 g/mol
SMILES N1c2c(Sc3c1cccc3)ccc(c2)C=1CC(c2ccccc2)N(N1)c1scc(n1)-c1ccccc1
SPLASH splash10-0uk9-0691070000-05cf17428c65643e2f1d
Source of Spectrum Y-54-1376-31
Thin-Layer Chromatography Rf = 0.83 (pet. ether (40-60)/ethyl acetate, 4:1)
Wiley ID 1878180