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3-Azabicyclo[3.1.0]hexane-1,5-dicarbonitrile, 6-(1,3-benzodioxol-5-yl)-2,4-dioxo-
SpectraBase Compound ID HTlZzpfndya
InChI InChI=1S/C14H7N3O4/c15-4-13-10(14(13,5-16)12(19)17-11(13)18)7-1-2-8-9(3-7)21-6-20-8/h1-3,10H,6H2,(H,17,18,19)
InChIKey JBXMSNZVHARBGV-UHFFFAOYSA-N
Mol Weight 281.23 g/mol
Molecular Formula C14H7N3O4
Exact Mass 281.043656 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID DVAWrU6Ow1A
Name 3-Azabicyclo[3.1.0]hexane-1,5-dicarbonitrile, 6-(1,3-benzodioxol-5-yl)-2,4-dioxo-
Alternate Name(s) 6-(1,3-benzodioxol-5-yl)-2,4-dioxo-3-azabicyclo[3.1.0]hexane-1,5-dicarbonitrile 6-(1,3-benzodioxol-5-yl)-2,4-bis(oxidanylidene)-3-azabicyclo[3.1.0]hexane-1,5-dicarbonitrile
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C14H7N3O4
InChI InChI=1S/C14H7N3O4/c15-4-13-10(14(13,5-16)12(19)17-11(13)18)7-1-2-8-9(3-7)21-6-20-8/h1-3,10H,6H2,(H,17,18,19)
InChIKey JBXMSNZVHARBGV-UHFFFAOYSA-N
Molecular Weight 281.227 g/mol
SMILES N1C(C2(C(C1=O)(C2c1ccc2c(c1)OCO2)C#N)C#N)=O
SPLASH splash10-0f79-5980000000-d8c2380c9fa4b57de34c
Source of Spectrum IY-1-4432-6
Wiley ID 1652309