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2-Propenoic acid, 2-chloro-3-[[2,5-dihydro-2-oxo-4-[[(triphenylmethyl)thio]methyl]-3-fu ranyl]amino]-, methyl ester
SpectraBase Compound ID GWQFxM3rz6N
InChI InChI=1S/C28H24ClNO4S/c1-33-26(31)24(29)17-30-25-20(18-34-27(25)32)19-35-28(21-11-5-2-6-12-21,22-13-7-3-8-14-22)23-15-9-4-10-16-23/h2-17,30H,18-19H2,1H3/b24-17-
InChIKey AQECFWGOHNRZAW-ULJHMMPZSA-N
Mol Weight 506.02 g/mol
Molecular Formula C28H24ClNO4S
Exact Mass 505.111457 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID KHqa2mPR10Z
Name 2-Propenoic acid, 2-chloro-3-[[2,5-dihydro-2-oxo-4-[[(triphenylmethyl)thio]methyl]-3-fu ranyl]amino]-, methyl ester
Alternate Name(s) 3-(n-.beta.-carbomethoxy-.beta.-chloro-vinylamino)-4-((triphenylmethylthio)methyl)-2,5-dihydrofuran-2-one Methyl (2Z)-2-chloro-3-({2-oxo-4-[(tritylsulfanyl)methyl]-2,5-dihydro-3-furanyl}amino)-2-propenoate
CAS Registry Number 65091-49-8
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C28H24ClNO4S
InChI InChI=1S/C28H24ClNO4S/c1-33-26(31)24(29)17-30-25-20(18-34-27(25)32)19-35-28(21-11-5-2-6-12-21,22-13-7-3-8-14-22)23-15-9-4-10-16-23/h2-17,30H,18-19H2,1H3/b24-17-
InChIKey AQECFWGOHNRZAW-ULJHMMPZSA-N
Molecular Weight 506.016 g/mol
SMILES N(C1=C(CSC(c2ccccc2)(c2ccccc2)c2ccccc2)COC1=O)\C=C\(C(=O)OC)Cl
SPLASH splash10-014l-0970000000-f24948e15fe566a1366f
Source of Spectrum H-60-2082-0
Wiley ID 1399705