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4-[(3'-Oxo-2'-{ethoxycarbonyl}but-1'-enyl)amino]-1H-(1,3)-benzodiazole
SpectraBase Compound ID JRxBcFOfaNS
InChI InChI=1S/C14H15N3O3/c1-3-20-14(19)10(9(2)18)7-15-11-5-4-6-12-13(11)17-8-16-12/h4-8,15H,3H2,1-2H3,(H,16,17)/b10-7+
InChIKey OLWHBDTYSYQHTI-JXMROGBWSA-N
Mol Weight 273.29 g/mol
Molecular Formula C14H15N3O3
Exact Mass 273.111341 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID CKXhRt802Wx
Name 4-[(3'-Oxo-2'-{ethoxycarbonyl}but-1'-enyl)amino]-1H-(1,3)-benzodiazole
Alternate Name(s) Ethyl (2E)-2-acetyl-3-(1H-benzimidazol-4-ylamino)-2-propenoate
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C14H15N3O3
InChI InChI=1S/C14H15N3O3/c1-3-20-14(19)10(9(2)18)7-15-11-5-4-6-12-13(11)17-8-16-12/h4-8,15H,3H2,1-2H3,(H,16,17)/b10-7+
InChIKey OLWHBDTYSYQHTI-JXMROGBWSA-N
Molecular Weight 273.292 g/mol
SMILES N(\C=C\(C(=O)OCC)C(=O)C)c1c2c([nH]cn2)ccc1
SPLASH splash10-001i-1970000000-e1a02cdd292bd28b1aca
Source of Spectrum G-57-537-0
Wiley ID 813272