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[alpha-(p-tolythio)-p-toluoyl]carbamic acid, o-tert-butylphenyl ester
SpectraBase Compound ID 7Xi6NC4vzNI
InChI InChI=1S/C26H27NO3S/c1-18-9-15-21(16-10-18)31-17-19-11-13-20(14-12-19)24(28)27-25(29)30-23-8-6-5-7-22(23)26(2,3)4/h5-16H,17H2,1-4H3,(H,27,28,29)
InChIKey AVDNYCGXXJOABP-UHFFFAOYSA-N
Mol Weight 433.57 g/mol
Molecular Formula C26H27NO3S
Exact Mass 433.171165 g/mol

13C Nuclear Magnetic Resonance (NMR) Spectrum

13C Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID CcQfpVVaiBJ
Name [alpha-(p-TOLYLTHIO)-p-TOLUOYL]CARBAMIC ACID, o-tert-BUTYLPHENYL ESTER
Source of Sample Maybridge Chemical Company Ltd., North Cornwall, England
Comments Tentative assignment
Copyright Copyright © 1980, 1981-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C26H27NO3S
InChI InChI=1S/C26H27NO3S/c1-18-9-15-21(16-10-18)31-17-19-11-13-20(14-12-19)24(28)27-25(29)30-23-8-6-5-7-22(23)26(2,3)4/h5-16H,17H2,1-4H3,(H,27,28,29)
InChIKey AVDNYCGXXJOABP-UHFFFAOYSA-N
Melting Point 128C
Molecular Weight 433.57
Solvent Chloroform-d; Reference=TMS Spectrometer= Varian CFT-20
Synonyms CARBAMIC ACID, /A-/P-TOLYLTHIO/- P-TOLUOYL/-, O-tert-BUTYLPHENYL ESTER