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4,9-Diamino-5-methyl-2-p-tolyl-2H-pyrrolo[3,4-g]phthalazine-1,6,8-trione
SpectraBase Compound ID F62AKUqKkI5
InChI InChI=1S/C18H15N5O3/c1-7-3-5-9(6-4-7)23-18(26)13-10(15(20)22-23)8(2)11-12(14(13)19)17(25)21-16(11)24/h3-6H,19H2,1-2H3,(H2,20,22)(H,21,24,25)
InChIKey XYMNKHNMJMGOIG-UHFFFAOYSA-N
Mol Weight 349.35 g/mol
Molecular Formula C18H15N5O3
Exact Mass 349.117489 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID BkkVDKo4Wwk
Name 4,9-Diamino-5-methyl-2-p-tolyl-2H-pyrrolo[3,4-g]phthalazine-1,6,8-trione
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C18H15N5O3
InChI InChI=1S/C18H15N5O3/c1-7-3-5-9(6-4-7)23-18(26)13-10(15(20)22-23)8(2)11-12(14(13)19)17(25)21-16(11)24/h3-6H,19H2,1-2H3,(H2,20,22)(H,21,24,25)
InChIKey XYMNKHNMJMGOIG-UHFFFAOYSA-N
Molecular Weight 349.350 g/mol
SMILES Nc1c2c(c(c3c1C(N(N=C3N)c1ccc(cc1)C)=O)C)C(=O)NC2=O
SPLASH splash10-0002-0129000000-96132c5a9a6fe454bbfc
Source of Spectrum Y-45-363-17a
Synonyms 1,5-Diamino-9-methyl-3-(4-methylphenyl)pyrrolo[3,4-g]phthalazine-4,6,8-trione 1,5-bis(azanyl)-9-methyl-3-(4-methylphenyl)pyrrolo[3,4-g]phthalazine-4,6,8-trione
Wiley ID 1666242