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2,7-Di(maleonitrilformalidino)-3,4,5,6-tetrahydro-1,8(2H,7H)acridinedione
SpectraBase Compound ID ErvMM0ydMt5
InChI InChI=1S/C23H17N9O2/c24-6-16(28)20(8-26)30-10-12-1-3-18-14(22(12)33)5-15-19(32-18)4-2-13(23(15)34)11-31-21(9-27)17(29)7-25/h5,10-13H,1-4,28-29H2/b20-16+,21-17+,30-10+,31-11+
InChIKey NBUODCVKFYOQFT-SOLBOVSMSA-N
Mol Weight 451.45 g/mol
Molecular Formula C23H17N9O2
Exact Mass 451.150521 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID H2LfKpWmXlt
Name 2,7-Di(maleonitrilformalidino)-3,4,5,6-tetrahydro-1,8(2H,7H)acridinedione
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C23H17N9O2
InChI InChI=1S/C23H17N9O2/c24-6-16(28)20(8-26)30-10-12-1-3-18-14(22(12)33)5-15-19(32-18)4-2-13(23(15)34)11-31-21(9-27)17(29)7-25/h5,10-13H,1-4,28-29H2/b20-16+,21-17+,30-10+,31-11+
InChIKey NBUODCVKFYOQFT-SOLBOVSMSA-N
Molecular Weight 451.450 g/mol
SMILES N\C(=C/(\N=C\C1C(c2cc3C(C(\C=N\C(=C\(C#N)N)C#N)CCc3nc2CC1)=O)=O)C#N)C#N
SPLASH splash10-014i-0920000000-b22eb028a88420784f95
Source of Spectrum Y1-36-23-6
Wiley ID 1526909