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1,3-Dihydro-5-nitro-1,3-dioxo-2H-isoindole-2-carbonitrile
SpectraBase Compound ID 5CeG3wnebXe
InChI InChI=1S/C9H3N3O4/c10-4-11-8(13)6-2-1-5(12(15)16)3-7(6)9(11)14/h1-3H
InChIKey XUEUTWYBSMBNFM-UHFFFAOYSA-N
Mol Weight 217.14 g/mol
Molecular Formula C9H3N3O4
Exact Mass 217.012356 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 7Z1hOlsEID4
Name 1,3-Dihydro-5-nitro-1,3-dioxo-2H-isoindole-2-carbonitrile
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C9H3N3O4
InChI InChI=1S/C9H3N3O4/c10-4-11-8(13)6-2-1-5(12(15)16)3-7(6)9(11)14/h1-3H
InChIKey XUEUTWYBSMBNFM-UHFFFAOYSA-N
Molecular Weight 217.140 g/mol
SMILES C1(N(C(c2ccc(cc12)N(=O)=O)=O)C#N)=O
SPLASH splash10-0g2a-9750000000-e0b0c4b1caa07aba1b18
Source of Spectrum SK-21-2029-3
Synonyms 1,3-Diketo-5-nitro-isoindoline-2-carbonitrile 5-Nitro-1,3-bis(oxidanylidene)isoindole-2-carbonitrile 5-Nitro-1,3-dioxo-2-isoindolecarbonitrile 5-Nitro-1,3-dioxo-isoindoline-2-carbonitrile 5-Nitro-1,3-dioxoisoindole-2-carbonitrile
Wiley ID 851912