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Ethyl 2-amino-5-[(benzylamino)carbonyl]-4-methyl-3-thiophenecarboxylate

View entire compound with spectra: 1 NMR, and 1 MS (GC)

Ethyl 2-amino-5-[(benzylamino)carbonyl]-4-methyl-3-thiophenecarboxylate
SpectraBase Compound ID 9M5xn6qtg6B
InChI InChI=1S/C16H18N2O3S/c1-3-21-16(20)12-10(2)13(22-14(12)17)15(19)18-9-11-7-5-4-6-8-11/h4-8H,3,9,17H2,1-2H3,(H,18,19)
InChIKey XGNWDFWCJZXUQG-UHFFFAOYSA-N
Mol Weight 318.39 g/mol
Molecular Formula C16H18N2O3S
Exact Mass 318.103814 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID 9lrwaJ3PHCw
Name 3-thiophenecarboxylic acid, 2-amino-4-methyl-5-[[(phenylmethyl)amino]carbonyl]-, ethyl ester
Copyright Copyright © 2022-2024 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright © 2022-2024 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 318.103813619 u
Formula C16H18N2O3S
InChI InChI=1S/C16H18N2O3S/c1-3-21-16(20)12-10(2)13(22-14(12)17)15(19)18-9-11-7-5-4-6-8-11/h4-8H,3,9,17H2,1-2H3,(H,18,19)
InChIKey XGNWDFWCJZXUQG-UHFFFAOYSA-N
Molecular Weight 318.391 g/mol
NMR Offset 18.0068
NMR Spectrometer Frequency 500.134
Observed nucleus 1H
Sample State Soluted
Sample_ID 1H_CB_2017_13827
Solvent DMSO-d6
Source Vendor ID: NMR/10300367; Lab Info: LP; Lab Number: LP-2180881