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(Z)-3-(3-(4-methoxyphenyl)-1-phenylprop-2-yn-1-ylidene)-1-tosylindolin-2-one
SpectraBase Compound ID 9pJ4hBFA71b
InChI InChI=1S/C31H23NO4S/c1-22-12-19-26(20-13-22)37(34,35)32-29-11-7-6-10-28(29)30(31(32)33)27(24-8-4-3-5-9-24)21-16-23-14-17-25(36-2)18-15-23/h3-15,17-20H,1-2H3/b30-27+
InChIKey JHINDZOFCHVVNR-KDJFERLWSA-N
Mol Weight 505.59 g/mol
Molecular Formula C31H23NO4S
Exact Mass 505.134779 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 562e7kplFw
Name (Z)-3-(3-(4-methoxyphenyl)-1-phenylprop-2-yn-1-ylidene)-1-tosylindolin-2-one
Appearance Yellow solid
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Exact Mass 505.134779395 u
Formula C31H23NO4S
InChI InChI=1S/C31H23NO4S/c1-22-12-19-26(20-13-22)37(34,35)32-29-11-7-6-10-28(29)30(31(32)33)27(24-8-4-3-5-9-24)21-16-23-14-17-25(36-2)18-15-23/h3-15,17-20H,1-2H3/b30-27+
InChIKey JHINDZOFCHVVNR-KDJFERLWSA-N
Ionization Type EI
Literature Reference DOI 10.1002/chem.201802237
Molecular Weight 505.588 g/mol
Reported Formula C31H23NO4S
SMILES COC1=CC=C(C=C1)C#C\C(C1=CC=CC=C1)=C/1C(N(C2=C1C=CC=C2)S(C1=CC=C(C=C1)C)(=O)=O)=O
SPLASH splash10-0pi0-0009060000-4ba5b77b281be5fa3d4d
Source of Spectrum QE-24-SM7-5d (DOI: 10.1002/chem.201802237)
Wiley ID 1901707