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Carbamic acid, [4-[[[2-[[(1,1-dimethylethoxy)carbonyl]amino]ethenyl]thio]methyl]-2,5 -dihydro-2-oxo-3-furanyl]-, phenyl ester, (E)-
SpectraBase Compound ID LII3NIUgalV
InChI InChI=1S/C19H22N2O6S/c1-19(2,3)27-17(23)20-9-10-28-12-13-11-25-16(22)15(13)21-18(24)26-14-7-5-4-6-8-14/h4-10H,11-12H2,1-3H3,(H,20,23)(H,21,24)/b10-9+
InChIKey YHULCMLBZXNCAL-MDZDMXLPSA-N
Mol Weight 406.45 g/mol
Molecular Formula C19H22N2O6S
Exact Mass 406.119858 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID E3mrL8lp7XM
Name Carbamic acid, [4-[[[2-[[(1,1-dimethylethoxy)carbonyl]amino]ethenyl]thio]methyl]-2,5 -dihydro-2-oxo-3-furanyl]-, phenyl ester, (E)-
Alternate Name(s) phenyl 4-[({(E)-2-[(tert-butoxycarbonyl)amino]ethenyl}sulfanyl)methyl]-2-oxo-2,5-dihydro-3-furanylcarbamate trans-3-phenoxycarbonylamino-4-(b-(t-butoxycarbonylamino)-vinylthio)methyl-2-(5H)-furanone
CAS Registry Number 61485-41-4
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C19H22N2O6S
InChI InChI=1S/C19H22N2O6S/c1-19(2,3)27-17(23)20-9-10-28-12-13-11-25-16(22)15(13)21-18(24)26-14-7-5-4-6-8-14/h4-10H,11-12H2,1-3H3,(H,20,23)(H,21,24)/b10-9+
InChIKey YHULCMLBZXNCAL-MDZDMXLPSA-N
Molecular Weight 406.453 g/mol
SMILES N(C(OC(C)(C)C)=O)\C=C\SCC1=C(C(OC1)=O)NC(Oc1ccccc1)=O
SPLASH splash10-052f-9110000000-06fd9f5a596d31da9eb7
Source of Spectrum H-59-1996-11
Wiley ID 1372019