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3-(4-Benzimidazolyl)amino-2-ethoxycarbonyl-prop-2-enoic acid, ethyl ester

View entire compound with spectra: 4 NMR

3-(4-Benzimidazolyl)amino-2-ethoxycarbonyl-prop-2-enoic acid, ethyl ester
SpectraBase Compound ID JlbiyaonLNI
InChI InChI=1S/C15H17N3O4/c1-3-21-14(19)10(15(20)22-4-2)8-16-11-6-5-7-12-13(11)18-9-17-12/h5-9,16H,3-4H2,1-2H3,(H,17,18)
InChIKey FWKFIERCPPHPKO-UHFFFAOYSA-N
Mol Weight 303.32 g/mol
Molecular Formula C15H17N3O4
Exact Mass 303.121906 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID GP9VEAL80H2
Name 3-(4-Benzimidazolyl)amino-2-ethoxycarbonyl-prop-2-enoic acid, ethyl ester
CAS Registry Number 117398-18-2
Comments VARIAN VXR 300, 75.47 MHZ, SOLID STATE, CH2 PEAK OF ADAMANTANE AT 37.8 PPM AS EXTERNAL REFERENCE
Copyright Copyright © 2002-2025 Wiley-VCH GmbH. All Rights Reserved.
Formula C15H17N3O4
InChI InChI=1S/C15H17N3O4/c1-3-21-14(19)10(15(20)22-4-2)8-16-11-6-5-7-12-13(11)18-9-17-12/h5-9,16H,3-4H2,1-2H3,(H,17,18)
InChIKey FWKFIERCPPHPKO-UHFFFAOYSA-N
Instrument Name see comment
Literature Reference I. Goljer, V. Milata, D. Ilavsky, Magn. Res. Chem. 27, 138 (1989).
NMR Standard see comment
Origin Chemical Concepts. A Wiley Division. Weinheim, Germany