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2-Methyl-3-azido-2-iodo-1,2,3,4,6,13-hexahydrobenzo[g]pyridazino[1,2-b]phthalazine-6,13-dione isomer
SpectraBase Compound ID EidUUbhp1z2
InChI InChI=1S/C17H14IN5O2/c1-17(18)9-23-16(25)13-7-11-5-3-2-4-10(11)6-12(13)15(24)22(23)8-14(17)20-21-19/h2-7,14H,8-9H2,1H3
InChIKey LWLDPVCEEYKZEE-UHFFFAOYSA-N
Mol Weight 447.24 g/mol
Molecular Formula C17H14IN5O2
Exact Mass 447.01922 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 2IqcZNa5Ojc
Name 2-Methyl-3-azido-2-iodo-1,2,3,4,6,13-hexahydrobenzo[g]pyridazino[1,2-b]phthalazine-6,13-dione isomer
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Formula C17H14IN5O2
InChI InChI=1S/C17H14IN5O2/c1-17(18)9-23-16(25)13-7-11-5-3-2-4-10(11)6-12(13)15(24)22(23)8-14(17)20-21-19/h2-7,14H,8-9H2,1H3
InChIKey LWLDPVCEEYKZEE-UHFFFAOYSA-N
Molecular Weight 447.236 g/mol
SMILES C1(N2N(C(c3c1cc1c(c3)cccc1)=O)CC(C(C2)N=[N+]=[N-])(I)C)=O
SPLASH splash10-004j-0091600000-2a3ec2da7ba1505eee7c
Source of Spectrum F-49-246-23
Synonyms 3-Azido-2-iodo-2-methyl-1,2,3,4-tetrahydrobenzo[g]pyridazino[1,2-b]phthalazine-6,13-dione
Wiley ID 1386875