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8a(R)-Hydroxy-1,8a-dihydro-7,8-diphenyl-3-phenylamino-1,2,4-triazolo[4,3-b]pyridazine-6-thione
SpectraBase Compound ID FhY4XZPLYqY
InChI InChI=1S/C23H19N5OS/c29-23-20(17-12-6-2-7-13-17)19(16-10-4-1-5-11-16)21(30)26-28(23)22(25-27-23)24-18-14-8-3-9-15-18/h1-15,27,29H,(H,24,25)(H,26,30)/t23-/m1/s1
InChIKey OBCMVBLXQBHLPJ-HSZRJFAPSA-N
Mol Weight 413.5 g/mol
Molecular Formula C23H19N5OS
Exact Mass 413.131031 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 3hYXIEptktu
Name 8a(R)-Hydroxy-1,8a-dihydro-7,8-diphenyl-3-phenylamino-1,2,4-triazolo[4,3-b]pyridazine-6-thione
Appearance Yellow crystals
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C23H19N5OS
InChI InChI=1S/C23H19N5OS/c29-23-20(17-12-6-2-7-13-17)19(16-10-4-1-5-11-16)21(30)26-28(23)22(25-27-23)24-18-14-8-3-9-15-18/h1-15,27,29H,(H,24,25)(H,26,30)/t23-/m1/s1
InChIKey OBCMVBLXQBHLPJ-HSZRJFAPSA-N
Instrument Name Finnigan MAT 8430
Ionization Type EI
Literature Reference DOI 10.3998/ark.5550190.0008.e01
Molecular Weight 413.499 g/mol
SMILES N1N2[C@@](C(=C(C1=S)c1ccccc1)c1ccccc1)(NN=C2Nc1ccccc1)O
SPLASH splash10-03di-4279600000-d82ce7eef8a2eb6b50f8
Source of Spectrum ARK-2007-8-3b
Wiley ID 1868868