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2,7-Dimethyl-8-phenylazo-3-[N-phenyl-1-ethoxycarbonyl-methanehydrazonoyl-pyrazolo-[1,5-a]pyrimidin-4(3H)-one
SpectraBase Compound ID H6Qm2YbeREg
InChI InChI=1S/C24H23N7O3/c1-4-34-24(33)21(29-27-18-13-9-6-10-14-18)19-15(2)25-22-20(16(3)30-31(22)23(19)32)28-26-17-11-7-5-8-12-17/h5-14,19,27H,4H2,1-3H3
InChIKey VQZURWCIEQPOAD-UHFFFAOYSA-N
Mol Weight 457.49 g/mol
Molecular Formula C24H23N7O3
Exact Mass 457.186238 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID D3UppJg9wJL
Name 2,7-Dimethyl-8-phenylazo-3-[N-phenyl-1-ethoxycarbonyl-methanehydrazonoyl-pyrazolo-[1,5-a]pyrimidin-4(3H)-one
Appearance Yellow solid
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C24H23N7O3
InChI InChI=1S/C24H23N7O3/c1-4-34-24(33)21(29-27-18-13-9-6-10-14-18)19-15(2)25-22-20(16(3)30-31(22)23(19)32)28-26-17-11-7-5-8-12-17/h5-14,19,27H,4H2,1-3H3
InChIKey VQZURWCIEQPOAD-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 457.494 g/mol
SMILES N(N=C(C1C(=Nc2[n](nc(c2N=Nc2ccccc2)C)C1=O)C)C(OCC)=O)c1ccccc1
SPLASH splash10-014l-4690000000-a96d493e80c4cb4bf9de
Source of Spectrum ARK-2009-166-3f
Wiley ID 1869611