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(E)-methyl 3-(1-((N-benzyl-4-methylphenylsulfonamido)ethynyl)cyclohexyloxy)acrylate
SpectraBase Compound ID 6VDPFN8X2NO
InChI InChI=1S/C26H29NO5S/c1-22-11-13-24(14-12-22)33(29,30)27(21-23-9-5-3-6-10-23)19-18-26(16-7-4-8-17-26)32-20-15-25(28)31-2/h3,5-6,9-15,20H,4,7-8,16-17,21H2,1-2H3/b20-15+
InChIKey UEILOLTUEVAVHS-HMMYKYKNSA-N
Mol Weight 467.58 g/mol
Molecular Formula C26H29NO5S
Exact Mass 467.176644 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 7C3VUSETI49
Name (E)-methyl 3-(1-((N-benzyl-4-methylphenylsulfonamido)ethynyl)cyclohexyloxy)acrylate
Appearance Yellowish liquid
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Exact Mass 467.176644207 u
Formula C26H29NO5S
InChI InChI=1S/C26H29NO5S/c1-22-11-13-24(14-12-22)33(29,30)27(21-23-9-5-3-6-10-23)19-18-26(16-7-4-8-17-26)32-20-15-25(28)31-2/h3,5-6,9-15,20H,4,7-8,16-17,21H2,1-2H3/b20-15+
InChIKey UEILOLTUEVAVHS-HMMYKYKNSA-N
Instrument Name Hewlett-Packard 5995
Ionization Type EI
Literature Reference DOI 10.1002/chem.201503171
Molecular Weight 467.580 g/mol
Quality 33
Reported Formula C26H29NO5S
SMILES C1CCC(CC1)(C#CN(S(C1=CC=C(C=C1)C)(=O)=O)CC1=CC=CC=C1)O\C=C\C(OC)=O
SPLASH splash10-0006-9010000000-2911613bb987974e00ed
Source of Spectrum QE-21-SM5-1o (DOI: 10.1002/chem.201503171)
Wiley ID 1907472