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2,7-Dimethyl-8-phenylazo-3-[(N-phenyl-1-phenylmethane-hydrazonoyl)]pyrazolo-[1,5-a]pyrimidin-4(3H)-one
SpectraBase Compound ID Gs3TzJyMJst
InChI InChI=1S/C27H23N7O/c1-18-23(25(20-12-6-3-7-13-20)32-30-22-16-10-5-11-17-22)27(35)34-26(28-18)24(19(2)33-34)31-29-21-14-8-4-9-15-21/h3-17,23,30H,1-2H3
InChIKey LKWDSZUUNXUKLH-UHFFFAOYSA-N
Mol Weight 461.53 g/mol
Molecular Formula C27H23N7O
Exact Mass 461.196408 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID AXEMhnITiKv
Name 2,7-Dimethyl-8-phenylazo-3-[(N-phenyl-1-phenylmethane-hydrazonoyl)]pyrazolo-[1,5-a]pyrimidin-4(3H)-one
Appearance Yellow solid
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C27H23N7O
InChI InChI=1S/C27H23N7O/c1-18-23(25(20-12-6-3-7-13-20)32-30-22-16-10-5-11-17-22)27(35)34-26(28-18)24(19(2)33-34)31-29-21-14-8-4-9-15-21/h3-17,23,30H,1-2H3
InChIKey LKWDSZUUNXUKLH-UHFFFAOYSA-N
Instrument Name Shimadzu GCMS-Q1000-EX or GCMS 5988-A HP
Ionization Type EI
Literature Reference DOI 10.3998/ark.5550190.0010.a16
Molecular Weight 461.529 g/mol
SMILES N(N=C(C1C(=Nc2[n](nc(c2N=Nc2ccccc2)C)C1=O)C)c1ccccc1)c1ccccc1
SPLASH splash10-0006-8910200000-24611c2c3fb249291e39
Source of Spectrum ARK-2009-165-3a
Wiley ID 1869606