| SpectraBase Spectrum ID |
DOQb1ZLqmUp |
| Name |
1-(1-benzyl-5-methyl-2-methylsulfanyl-pyrrol-3-yl)ethanone |
| Alternate Name(s) |
1-[1-benzyl-5-methyl-2-(methylthio)pyrrol-3-yl]ethanone
1-[5-methyl-2-(methylthio)-1-(phenylmethyl)-3-pyrrolyl]ethanone
1-[5-methyl-2-methylsulfanyl-1-(phenylmethyl)pyrrol-3-yl]ethanone |
| Comments |
Less than 3 mono-isotopic peaks |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C15H17NOS |
| InChI |
InChI=1S/C15H17NOS/c1-11-9-14(12(2)17)15(18-3)16(11)10-13-7-5-4-6-8-13/h4-9H,10H2,1-3H3 |
| InChIKey |
XWXHIPJVLMUOCI-UHFFFAOYSA-N |
| Molecular Weight |
259.367 g/mol |
| SMILES |
c1(c([n](Cc2ccccc2)c(c1)C)SC)C(=O)C |
| SPLASH |
splash10-0a4i-0090000000-358110dafe57ee3b7ee7 |
| Source of Spectrum |
KC-0-1726-11 |
| Wiley ID |
784062 |
