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1-(2H-1,3-benzodioxol-5-ylmethyl)-4-(2,4-dichlorophenyl)-1H,4H,5H,6H,7H-pyrazolo[3,4-b]pyridin-6-one
SpectraBase Compound ID 8mN5JxywwJY
InChI InChI=1S/C20H15Cl2N3O3/c21-12-2-3-13(16(22)6-12)14-7-19(26)24-20-15(14)8-23-25(20)9-11-1-4-17-18(5-11)28-10-27-17/h1-6,8,14H,7,9-10H2,(H,24,26)
InChIKey XIXCLKQODZRCNI-UHFFFAOYSA-N
Mol Weight 416.26 g/mol
Molecular Formula C20H15Cl2N3O3
Exact Mass 415.049047 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 2yFM1IcEAQZ
Name 1-(2H-1,3-benzodioxol-5-ylmethyl)-4-(2,4-dichlorophenyl)-1H,4H,5H,6H,7H-pyrazolo[3,4-b]pyridin-6-one
Alternate Name(s) 6H-Pyrazolo[3,4-b]pyridin-6-one, 1-(1,3-benzodioxol-5-ylmethyl)-4-(2,4-dichlorophenyl)-1,4,5,7-tetrahydro-
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C20H15Cl2N3O3
InChI InChI=1S/C20H15Cl2N3O3/c21-12-2-3-13(16(22)6-12)14-7-19(26)24-20-15(14)8-23-25(20)9-11-1-4-17-18(5-11)28-10-27-17/h1-6,8,14H,7,9-10H2,(H,24,26)
InChIKey XIXCLKQODZRCNI-UHFFFAOYSA-N
Molecular Weight 416.264 g/mol
SMILES N1C(CC(c2c1[n](nc2)Cc1ccc2OCOc2c1)c1ccc(cc1Cl)Cl)=O
SPLASH splash10-000i-2900000000-2c24ab920a9599413048
Source of Spectrum IY-2-5081-7
Wiley ID 1658800