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3-(5-Benztriazolyl)amino-2-ethoxycarbonyl-prop-2-enoic acid, ethyl ester
SpectraBase Compound ID BsiB0vqYiYI
InChI InChI=1S/C14H16N4O4/c1-3-21-13(19)10(14(20)22-4-2)8-15-9-5-6-11-12(7-9)17-18-16-11/h5-8,15H,3-4H2,1-2H3,(H,16,17,18)
InChIKey PGZHEJJSLIFJCM-UHFFFAOYSA-N
Mol Weight 304.31 g/mol
Molecular Formula C14H16N4O4
Exact Mass 304.117155 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID Jq7hyBR5qCg
Name 3-(5-Benztriazolyl)amino-2-ethoxycarbonyl-prop-2-enoic acid, ethyl ester
CAS Registry Number 117398-17-1
Comments VARIAN VXR 300, 75.47 MHZ, SOLID STATE, CH2 PEAK OF ADAMANTANE AT 37.8 PPM AS EXTERNAL REFERENCE
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Formula C14H16N4O4
InChI InChI=1S/C14H16N4O4/c1-3-21-13(19)10(14(20)22-4-2)8-15-9-5-6-11-12(7-9)17-18-16-11/h5-8,15H,3-4H2,1-2H3,(H,16,17,18)
InChIKey PGZHEJJSLIFJCM-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