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2-Chloroethyl 5-chloro-1-phenyl-1H-indole-3-sulfonate
SpectraBase Compound ID 7hucH7GIVoG
InChI InChI=1S/C16H13Cl2NO3S/c17-8-9-22-23(20,21)16-11-19(13-4-2-1-3-5-13)15-7-6-12(18)10-14(15)16/h1-7,10-11H,8-9H2
InChIKey ACRLKBXUTMDJKB-UHFFFAOYSA-N
Mol Weight 370.25 g/mol
Molecular Formula C16H13Cl2NO3S
Exact Mass 368.99932 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID GGINnRE12Lh
Name 2-Chloroethyl 5-chloro-1-phenyl-1H-indole-3-sulfonate
Appearance Yellow solid
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Exact Mass 368.999319854 u
Formula C16H13Cl2NO3S
InChI InChI=1S/C16H13Cl2NO3S/c17-8-9-22-23(20,21)16-11-19(13-4-2-1-3-5-13)15-7-6-12(18)10-14(15)16/h1-7,10-11H,8-9H2
InChIKey ACRLKBXUTMDJKB-UHFFFAOYSA-N
Instrument Name Agilent 5975N
Ionization Type EI
Literature Reference DOI 10.1002/anie.201612565
Molecular Weight 370.250 g/mol
Reported Formula C16H12Cl2NO3S
SMILES C1(S(OCCCl)(=O)=O)=CN(C2=C1C=C(C=C2)Cl)C1=CC=CC=C1
SPLASH splash10-004i-0096000000-92cae021bfb5511c7c83
Source of Spectrum ACI-56-SM21-2l (DOI: 10.1002/anie.201612565)
Wiley ID 1895529