| SpectraBase Spectrum ID |
A9wTltVGhN8 |
| Name |
Methyl 3-(3-((2-chloroethoxy)sulfonyl)-1H-indol-1-yl)benzoate |
| Appearance |
Yellow solid |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
393.043771488 u |
| Formula |
C18H16ClNO5S |
| InChI |
InChI=1S/C18H16ClNO5S/c1-24-18(21)13-5-4-6-14(11-13)20-12-17(26(22,23)25-10-9-19)15-7-2-3-8-16(15)20/h2-8,11-12H,9-10H2,1H3 |
| InChIKey |
JZLPPFZPDWFCEO-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)C1=CC=CC(=C1)C(=O)OC |
| SPLASH |
splash10-0f6x-0498000000-48445a434370b2392e58 |
| Source of Spectrum |
ACI-56-SM19-2f (DOI: 10.1002/anie.201612565) |
| Wiley ID |
1895525 |
