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cis-N-[2-(acetonylthio)-1-(cyanomethyl)-4-oxo-3-azetidinyl]-2-phenylacetamide
SpectraBase Compound ID 998DRlEQWT5
InChI InChI=1S/C16H17N3O3S/c1-11(20)10-23-16-14(15(22)19(16)8-7-17)18-13(21)9-12-5-3-2-4-6-12/h2-6,14,16H,8-10H2,1H3,(H,18,21)/t14-,16-/s2
InChIKey KYWIXRKZHRGDTD-VTLFJGNJSA-N
Mol Weight 331.39 g/mol
Molecular Formula C16H17N3O3S
Exact Mass 331.099063 g/mol

13C Nuclear Magnetic Resonance (NMR) Spectrum

13C Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID A51Sos2bL55
Name cis-N-[2-(ACETONYLTHIO)-1-(CYANOMETHYL)-4-OXO-3-AZETIDINYL]-2-PHENYLACETAMIDE
Source of Sample R. Lattrell, Hoechst AG, Frankfurt/Main, Germany
Copyright Copyright © 1980, 1981-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C16H17N3O3S
InChI InChI=1S/C16H17N3O3S/c1-11(20)10-23-16-14(15(22)19(16)8-7-17)18-13(21)9-12-5-3-2-4-6-12/h2-6,14,16H,8-10H2,1H3,(H,18,21)/t14-,16-/s2
InChIKey KYWIXRKZHRGDTD-VTLFJGNJSA-N
Melting Point 94-95C
Molecular Weight 331.40
Solvent Polysol; Reference=TMS Spectrometer= Varian CFT-20
Synonyms ACETAMIDE, N-/2-/ACETONYLTHIO/- 1-/CYANOMETHYL/-4-OXO-3-AZETIDINYL/- 2-PHENYL-, cis-,