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4,4'-Methylenebis[2-(3-(1,3-benzodioxol-5-yl)-4,5-dihydro-1H-pyrazol-5-yl)phenol]
SpectraBase Compound ID 4oEfuFn9X70
InChI InChI=1S/C33H28N4O6/c38-28-5-1-18(10-22(28)26-14-24(34-36-26)20-3-7-30-32(12-20)42-16-40-30)9-19-2-6-29(39)23(11-19)27-15-25(35-37-27)21-4-8-31-33(13-21)43-17-41-31/h1-8,10-13,26-27,36-39H,9,14-17H2
InChIKey NDVBMXOFUZOWBW-UHFFFAOYSA-N
Mol Weight 576.6 g/mol
Molecular Formula C33H28N4O6
Exact Mass 576.200885 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID IgvI87WelK0
Name 4,4'-Methylenebis[2-(3-(1,3-benzodioxol-5-yl)-4,5-dihydro-1H-pyrazol-5-yl)phenol]
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C33H28N4O6
InChI InChI=1S/C33H28N4O6/c38-28-5-1-18(10-22(28)26-14-24(34-36-26)20-3-7-30-32(12-20)42-16-40-30)9-19-2-6-29(39)23(11-19)27-15-25(35-37-27)21-4-8-31-33(13-21)43-17-41-31/h1-8,10-13,26-27,36-39H,9,14-17H2
InChIKey NDVBMXOFUZOWBW-UHFFFAOYSA-N
Molecular Weight 576.609 g/mol
SMILES N1C(c2cc(Cc3ccc(c(c3)C3NN=C(C3)c3cc4OCOc4cc3)O)ccc2O)CC(=N1)c1cc2OCOc2cc1
SPLASH splash10-000i-0900020000-0ac7a95897413c2e4acc
Source of Spectrum F2-46-2439-4e
Synonyms 2-[3-(1,3-benzodioxol-5-yl)-4,5-dihydro-1H-pyrazol-5-yl]-4-[[3-[3-(1,3-benzodioxol-5-yl)-4,5-dihydro-1H-pyrazol-5-yl]-4-hydroxyphenyl]methyl]phenol 2-[3-(1,3-benzodioxol-5-yl)-4,5-dihydro-1H-pyrazol-5-yl]-4-[[3-[3-(1,3-benzodioxol-5-yl)-4,5-dihydro-1H-pyrazol-5-yl]-4-hydroxy-phenyl]methyl]phenol 2-[3-(1,3-benzodioxol-5-yl)-4,5-dihydro-1H-pyrazol-5-yl]-4-[[3-[3-(1,3-benzodioxol-5-yl)-4,5-dihydro-1H-pyrazol-5-yl]-4-oxidanyl-phenyl]methyl]phenol
Wiley ID 1689652