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6H-Pyrazolo[3,4-b]pyridin-6-one, 4-(1,3-benzodioxol-5-yl)-1-(1,3-benzodioxol-5-ylmethyl)-1,4,5,7-tetrahydro-
SpectraBase Compound ID 5NwUWCQ5iGK
InChI InChI=1S/C21H17N3O5/c25-20-7-14(13-2-4-17-19(6-13)29-11-27-17)15-8-22-24(21(15)23-20)9-12-1-3-16-18(5-12)28-10-26-16/h1-6,8,14H,7,9-11H2,(H,23,25)
InChIKey HVPUTSXDSAHFIN-UHFFFAOYSA-N
Mol Weight 391.38 g/mol
Molecular Formula C21H17N3O5
Exact Mass 391.116821 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 1G603YoAI7y
Name 6H-Pyrazolo[3,4-b]pyridin-6-one, 4-(1,3-benzodioxol-5-yl)-1-(1,3-benzodioxol-5-ylmethyl)-1,4,5,7-tetrahydro-
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C21H17N3O5
InChI InChI=1S/C21H17N3O5/c25-20-7-14(13-2-4-17-19(6-13)29-11-27-17)15-8-22-24(21(15)23-20)9-12-1-3-16-18(5-12)28-10-26-16/h1-6,8,14H,7,9-11H2,(H,23,25)
InChIKey HVPUTSXDSAHFIN-UHFFFAOYSA-N
Molecular Weight 391.383 g/mol
SMILES N1C(CC(c2c1[n](nc2)Cc1ccc2OCOc2c1)c1ccc2c(c1)OCO2)=O
SPLASH splash10-000l-2906000000-6e3978d05f9ca36e5f06
Source of Spectrum IY-1-4496-7
Wiley ID 1652950