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(2Z,2'Z)-Dimethyl 2,2'-(7-cyano-1H-benzo[b][1,4]diazepine-2,4(3H,5H)-diylidene)diacetate
SpectraBase Compound ID L8YGjZt0xXB
InChI InChI=1S/C16H15N3O4/c1-22-15(20)7-11-6-12(8-16(21)23-2)19-14-5-10(9-17)3-4-13(14)18-11/h3-5,7-8,18-19H,6H2,1-2H3/b11-7-,12-8-
InChIKey QQDZRKRLTITITP-OXAWKVHCSA-N
Mol Weight 313.31 g/mol
Molecular Formula C16H15N3O4
Exact Mass 313.106256 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID xF5SA36jw
Name (2Z,2'Z)-Dimethyl 2,2'-(7-cyano-1H-benzo[b][1,4]diazepine-2,4(3H,5H)-diylidene)diacetate
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C16H15N3O4
InChI InChI=1S/C16H15N3O4/c1-22-15(20)7-11-6-12(8-16(21)23-2)19-14-5-10(9-17)3-4-13(14)18-11/h3-5,7-8,18-19H,6H2,1-2H3/b11-7-,12-8-
InChIKey QQDZRKRLTITITP-OXAWKVHCSA-N
Molecular Weight 313.313 g/mol
SMILES N1\C(C\C(Nc2c1ccc(c2)C#N)=C/C(=O)OC)=C/C(=O)OC
SPLASH splash10-01qd-0393000000-3dea0bb821978d676bc7
Source of Spectrum F-68-6460-9i
Wiley ID 1717294