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Diisopropyl 1-((1-(4-Methoxyphenyl)-4,4-dimethyl-3-phenyl-4,5-dihydro-1H-pyrazol-5-yl)methyl)hydrazine-1,2-dicarboxylate
SpectraBase Compound ID 3ahuZ1ir5dE
InChI InChI=1S/C27H36N4O5/c1-18(2)35-25(32)29-30(26(33)36-19(3)4)17-23-27(5,6)24(20-11-9-8-10-12-20)28-31(23)21-13-15-22(34-7)16-14-21/h8-16,18-19,23H,17H2,1-7H3,(H,29,32)
InChIKey KAEITYUJLJSVTR-UHFFFAOYSA-N
Mol Weight 496.6 g/mol
Molecular Formula C27H36N4O5
Exact Mass 496.26857 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 7rFCfJpdye5
Name Diisopropyl 1-((1-(4-Methoxyphenyl)-4,4-dimethyl-3-phenyl-4,5-dihydro-1H-pyrazol-5-yl)methyl)hydrazine-1,2-dicarboxylate
Alternate Name(s) N-[[2-(4-methoxyphenyl)-4,4-dimethyl-5-phenyl-3H-pyrazol-3-yl]methyl]-N-[[oxo(propan-2-yloxy)methyl]amino]carbamic acid propan-2-yl ester Isopropyl N-(isopropoxycarbonylamino)-N-[[2-(4-methoxyphenyl)-4,4-dimethyl-5-phenyl-3H-pyrazol-3-yl]methyl]carbamate Propan-2-yl N-[[2-(4-methoxyphenyl)-4,4-dimethyl-5-phenyl-3H-pyrazol-3-yl]methyl]-N-(propan-2-yloxycarbonylamino)carbamate
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Formula C27H36N4O5
InChI InChI=1S/C27H36N4O5/c1-18(2)35-25(32)29-30(26(33)36-19(3)4)17-23-27(5,6)24(20-11-9-8-10-12-20)28-31(23)21-13-15-22(34-7)16-14-21/h8-16,18-19,23H,17H2,1-7H3,(H,29,32)
InChIKey KAEITYUJLJSVTR-UHFFFAOYSA-N
Literature Reference DOI 10.1021/jo4016908
Molecular Weight 496.608 g/mol
SMILES N(N(CC1N(N=C(C1(C)C)c1ccccc1)c1ccc(cc1)OC)C(OC(C)C)=O)C(OC(C)C)=O
SPLASH splash10-004i-3190100000-58e1728d8d9986146e26
Source of Spectrum J-78-10701-3g
Wiley ID 1747237