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(+/-)-[3α(S*),4β]-3-(1-Hydroxyethyl)-2-oxo-4-[(phenylthio)acetyl]-1-azetidineacetic acid, tert-butyl ester, acetate (ester)

View entire compound with spectra: 2 NMR, 1 FTIR, and 1 UV-Vis

(+/-)-[3α(S*),4β]-3-(1-Hydroxyethyl)-2-oxo-4-[(phenylthio)acetyl]-1-azetidineacetic acid, tert-butyl ester, acetate (ester)
SpectraBase Compound ID G0tzeHy8I8K
InChI InChI=1S/C21H27NO6S/c1-13(27-14(2)23)18-19(16(24)12-29-15-9-7-6-8-10-15)22(20(18)26)11-17(25)28-21(3,4)5/h6-10,13,18-19H,11-12H2,1-5H3/t13-,18-,19-/m1/s1
InChIKey MNVVUYQSMRZTDU-UPRAQXHNSA-N
Mol Weight 421.51 g/mol
Molecular Formula C21H27NO6S
Exact Mass 421.155909 g/mol

13C Nuclear Magnetic Resonance (NMR) Spectrum

13C Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID FnLInr9Gwtm
Name (+/-)-[3α(S*),4β]-3-(1-Hydroxyethyl)-2-oxo-4-[(phenylthio)acetyl]-1-azetidineacetic acid, tert-butyl ester, acetate (ester)
Source of Sample M. Shiozaki, Sankyo Company, Ltd., Tokyo, Japan
Comments Tentative assignment
Copyright Copyright © 1980, 1981-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C21H27NO6S
InChI InChI=1S/C21H27NO6S/c1-13(27-14(2)23)18-19(16(24)12-29-15-9-7-6-8-10-15)22(20(18)26)11-17(25)28-21(3,4)5/h6-10,13,18-19H,11-12H2,1-5H3/t13-,18-,19-/m1/s1
InChIKey MNVVUYQSMRZTDU-UPRAQXHNSA-N
Melting Point 94-95C
Solvent Chloroform-d; Reference=TMS Spectrometer= Varian CFT-20