| SpectraBase Spectrum ID |
AmAzYfi9AZU |
| Name |
Methyl 3-((2-chloroethoxy)sulfonyl)-1-phenyl-1H-indole-6-carboxylate |
| Appearance |
Yellow solid |
| Copyright |
Copyright © 2020-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
393.043771488 u |
| Formula |
C18H16ClNO5S |
| InChI |
InChI=1S/C18H16ClNO5S/c1-24-18(21)13-7-8-15-16(11-13)20(14-5-3-2-4-6-14)12-17(15)26(22,23)25-10-9-19/h2-8,11-12H,9-10H2,1H3 |
| InChIKey |
JPKJWAFEHQXYRK-UHFFFAOYSA-N |
| Instrument Name |
Agilent 5975N |
| Ionization Type |
EI |
| Literature Reference DOI |
10.1002/anie.201612565 |
| Molecular Weight |
393.841 g/mol |
| Reported Formula |
C18H16ClNO5S |
| SMILES |
C1(S(OCCCl)(=O)=O)=CN(C2=C1C=CC(=C2)C(OC)=O)C1=CC=CC=C1 |
| SPLASH |
splash10-0udi-0098000000-e3da55d430af0b858eb5 |
| Source of Spectrum |
ACI-56-SM22-2n (DOI: 10.1002/anie.201612565) |
| Wiley ID |
1895531 |
