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2-Chloroethyl 1-(4-methoxyphenyl)-1H-indole-3-sulfonate
SpectraBase Compound ID FtSSBYPhya
InChI InChI=1S/C17H16ClNO4S/c1-22-14-8-6-13(7-9-14)19-12-17(24(20,21)23-11-10-18)15-4-2-3-5-16(15)19/h2-9,12H,10-11H2,1H3
InChIKey ZJZSOOCYZHXGJS-UHFFFAOYSA-N
Mol Weight 365.83 g/mol
Molecular Formula C17H16ClNO4S
Exact Mass 365.048857 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID J2MK0rEt03V
Name 2-Chloroethyl 1-(4-methoxyphenyl)-1H-indole-3-sulfonate
Appearance Yellow solid
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Exact Mass 365.048856869 u
Formula C17H16ClNO4S
InChI InChI=1S/C17H16ClNO4S/c1-22-14-8-6-13(7-9-14)19-12-17(24(20,21)23-11-10-18)15-4-2-3-5-16(15)19/h2-9,12H,10-11H2,1H3
InChIKey ZJZSOOCYZHXGJS-UHFFFAOYSA-N
Instrument Name Agilent 5975N
Ionization Type EI
Literature Reference DOI 10.1002/anie.201612565
Molecular Weight 365.831 g/mol
Reported Formula C17H16ClNO4S
SMILES C1(S(OCCCl)(=O)=O)=CN(C2=C1C=CC=C2)C1=CC=C(C=C1)OC
SPLASH splash10-01b9-0069000000-779569deba2376c56c69
Source of Spectrum ACI-56-SM18-2c (DOI: 10.1002/anie.201612565)
Wiley ID 1895522