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3-Cyano-5-dipentylamino-1,6-di(p-tolyl)-1H-pyrazolo[4,3-d]pyrimidin-7(6H)-one
SpectraBase Compound ID K7wfijgLZSc
InChI InChI=1S/C30H36N6O/c1-5-7-9-19-34(20-10-8-6-2)30-32-27-26(21-31)33-36(25-17-13-23(4)14-18-25)28(27)29(37)35(30)24-15-11-22(3)12-16-24/h11-18H,5-10,19-20H2,1-4H3
InChIKey ZLBMFKPPQPGQED-UHFFFAOYSA-N
Mol Weight 496.7 g/mol
Molecular Formula C30H36N6O
Exact Mass 496.29506 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 964LiE1jWWV
Name 3-Cyano-5-dipentylamino-1,6-di(p-tolyl)-1H-pyrazolo[4,3-d]pyrimidin-7(6H)-one
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C30H36N6O
InChI InChI=1S/C30H36N6O/c1-5-7-9-19-34(20-10-8-6-2)30-32-27-26(21-31)33-36(25-17-13-23(4)14-18-25)28(27)29(37)35(30)24-15-11-22(3)12-16-24/h11-18H,5-10,19-20H2,1-4H3
InChIKey ZLBMFKPPQPGQED-UHFFFAOYSA-N
Molecular Weight 496.659 g/mol
SMILES c12c(N=C(N(C2=O)c2ccc(cc2)C)N(CCCCC)CCCCC)c(C#N)n[n]1-c1ccc(C)cc1
SPLASH splash10-00p1-1006900000-cc5da1fde6b6ba2ba466
Source of Spectrum F-66-5119-8N
Wiley ID 1683262