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3-Nitrophthalazino[2,3-b]phthalazine-5,12(7H,14H)-dione
SpectraBase Compound ID 3KndB17eEi5
InChI InChI=1S/C16H11N3O4/c20-15-13-4-2-1-3-10(13)8-18-16(21)14-7-12(19(22)23)6-5-11(14)9-17(15)18/h1-7H,8-9H2
InChIKey VBYNSJHMCBRUAF-UHFFFAOYSA-N
Mol Weight 309.28 g/mol
Molecular Formula C16H11N3O4
Exact Mass 309.074956 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 8sv6gOSekbm
Name 3-Nitrophthalazino[2,3-b]phthalazine-5,12(7H,14H)-dione
Alternate Name(s) 2-Nitro-5,12-dihydrophthalazino[3,2-b]phthalazine-7,14-dione 2-Nitro-5,12-dihydrophthalazino[3,2-b]phthalazine-7,14-quinone 3-Nitrodiftalone
CAS Registry Number 21721-38-0
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C16H11N3O4
InChI InChI=1S/C16H11N3O4/c20-15-13-4-2-1-3-10(13)8-18-16(21)14-7-12(19(22)23)6-5-11(14)9-17(15)18/h1-7H,8-9H2
InChIKey VBYNSJHMCBRUAF-UHFFFAOYSA-N
Molecular Weight 309.281 g/mol
SMILES c1ccc2c(c1)CN1C(c3cc(ccc3CN1C2=O)N(=O)=O)=O
SPLASH splash10-0a59-5914000000-385ac3602283af3164f7
Source of Spectrum W5-1989-7066-1
Wiley ID 1310579