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2-Chloroethyl 1-phenyl-1H-indole-3-sulfonate
SpectraBase Compound ID Hsf2z73iAuX
InChI InChI=1S/C16H14ClNO3S/c17-10-11-21-22(19,20)16-12-18(13-6-2-1-3-7-13)15-9-5-4-8-14(15)16/h1-9,12H,10-11H2
InChIKey LLMQGVHLFANIOY-UHFFFAOYSA-N
Mol Weight 335.81 g/mol
Molecular Formula C16H14ClNO3S
Exact Mass 335.038292 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID J3txwj4T3OC
Name 2-Chloroethyl 1-phenyl-1H-indole-3-sulfonate
Appearance Yellow solid
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 335.038292186 u
Formula C16H14ClNO3S
InChI InChI=1S/C16H14ClNO3S/c17-10-11-21-22(19,20)16-12-18(13-6-2-1-3-7-13)15-9-5-4-8-14(15)16/h1-9,12H,10-11H2
InChIKey LLMQGVHLFANIOY-UHFFFAOYSA-N
Instrument Name Agilent 5975N
Ionization Type EI
Literature Reference DOI 10.1002/anie.201612565
Molecular Weight 335.805 g/mol
Reported Formula C16H14ClNO3S
SMILES C1(S(OCCCl)(=O)=O)=CN(C2=C1C=CC=C2)C1=CC=CC=C1
SPLASH splash10-052o-0869000000-cce1ba07036564d3a33b
Source of Spectrum ACI-56-SM17-2a (DOI: 10.1002/anie.201612565)
Wiley ID 1895520