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2,4-Dioxo-6-(3,4,5-trimethoxyphenyl)-3-azabicyclo[3.1.0]hexane-1,5-dicarbonitrile
SpectraBase Compound ID 2MWAn2A2PAR
InChI InChI=1S/C16H13N3O5/c1-22-9-4-8(5-10(23-2)11(9)24-3)12-15(6-17)13(20)19-14(21)16(12,15)7-18/h4-5,12H,1-3H3,(H,19,20,21)
InChIKey GUKCWXGGDQYJEQ-UHFFFAOYSA-N
Mol Weight 327.3 g/mol
Molecular Formula C16H13N3O5
Exact Mass 327.085521 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 4nKRaHhpY0
Name 2,4-Dioxo-6-(3,4,5-trimethoxyphenyl)-3-azabicyclo[3.1.0]hexane-1,5-dicarbonitrile
Alternate Name(s) 3-Azabicyclo[3.1.0]hexane-1,5-dicarbonitrile, 2,4-dioxo-6-(3,4,5-trimethoxyphenyl)- 2,4-bis(oxidanylidene)-6-(3,4,5-trimethoxyphenyl)-3-azabicyclo[3.1.0]hexane-1,5-dicarbonitrile
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C16H13N3O5
InChI InChI=1S/C16H13N3O5/c1-22-9-4-8(5-10(23-2)11(9)24-3)12-15(6-17)13(20)19-14(21)16(12,15)7-18/h4-5,12H,1-3H3,(H,19,20,21)
InChIKey GUKCWXGGDQYJEQ-UHFFFAOYSA-N
Molecular Weight 327.296 g/mol
SMILES N1C(C2(C(C1=O)(C2c1cc(c(c(OC)c1)OC)OC)C#N)C#N)=O
SPLASH splash10-0a6r-1981000000-4323de9bc4060d0e6eda
Source of Spectrum IY-2-4790-0
Wiley ID 1655883