SpectraBase Spectrum ID |
JgaN6MrZ8R6 |
Name |
3-(2'-Nitroethyl)-4-[2'-(butylthio)ethenyl]indole |
Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
Formula |
C16H20N2O2S |
InChI |
InChI=1S/C16H20N2O2S/c1-2-3-10-21-11-8-13-5-4-6-15-16(13)14(12-17-15)7-9-18(19)20/h4-6,8,11-12,17H,2-3,7,9-10H2,1H3/b11-8+ |
InChIKey |
ORMVMYKDKGRWPQ-DHZHZOJOSA-N |
Molecular Weight |
304.408 g/mol |
SMILES |
[nH]1c2c(c(c1)CCN(=O)=O)c(ccc2)\C=C\SCCCC |
SPLASH |
splash10-0uxr-0916000000-4a8b40fe44cccc6d83db |
Source of Spectrum |
U-1997-1976-39 |
Synonyms |
4-[(E)-2-(butylsulfanyl)ethenyl]-3-(2-nitroethyl)-1H-indole
Butyl (E)-2-[3-(2-nitroethyl)-1H-indol-4-yl]ethenyl sulfide |
Wiley ID |
770158 |