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1-Mercapto-2-methoxycarbonylamino-but-3-ene
SpectraBase Compound ID 6L7fZnYexCk
InChI InChI=1S/C6H11NO2S/c1-3-5(4-10)7-6(8)9-2/h3,5,10H,1,4H2,2H3,(H,7,8)
InChIKey YNNMPCNOMSGDDY-UHFFFAOYSA-N
Mol Weight 161.22 g/mol
Molecular Formula C6H11NO2S
Exact Mass 161.05105 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID KUOfPj7Anrw
Name 1-Mercapto-2-methoxycarbonylamino-but-3-ene
CAS Registry Number 114087-07-9
Copyright Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved.
Formula C6H11NO2S
InChI InChI=1S/C6H11NO2S/c1-3-5(4-10)7-6(8)9-2/h3,5,10H,1,4H2,2H3,(H,7,8)
InChIKey YNNMPCNOMSGDDY-UHFFFAOYSA-N
Instrument Name Bruker AM-360
Literature Reference E.H. Abd Elall, J.M. Mellor, J. Chem. Soc. Perkin I 2729 (1987).
NMR Standard TMS
Origin Chemical Concepts. A Wiley Division. Weinheim, Germany
Solvent CDCl3