| SpectraBase Spectrum ID |
EWj926nWGH4 |
| Name |
(1-benzyl-5-methyl-2-methylsulfanyl-pyrrol-3-yl)-(p-tolyl)methanone |
| Alternate Name(s) |
(1-benzyl-5-methyl-2-methylsulfanylpyrrol-3-yl)-(4-methylphenyl)methanone
[1-benzyl-5-methyl-2-(methylthio)pyrrol-3-yl]-(p-tolyl)methanone
[5-methyl-2-(methylthio)-1-(phenylmethyl)-3-pyrrolyl]-(4-methylphenyl)methanone
[5-methyl-2-methylsulfanyl-1-(phenylmethyl)pyrrol-3-yl]-(4-methylphenyl)methanone |
| Comments |
Less than 3 mono-isotopic peaks |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C21H21NOS |
| InChI |
InChI=1S/C21H21NOS/c1-15-9-11-18(12-10-15)20(23)19-13-16(2)22(21(19)24-3)14-17-7-5-4-6-8-17/h4-13H,14H2,1-3H3 |
| InChIKey |
FQDGTCVODJABBW-UHFFFAOYSA-N |
| Molecular Weight |
335.465 g/mol |
| SMILES |
c1(c([n](Cc2ccccc2)c(c1)C)SC)C(c1ccc(cc1)C)=O |
| SPLASH |
splash10-000i-0009000000-48a0d6e2b085e2641d60 |
| Source of Spectrum |
KC-0-1726-11 |
| Wiley ID |
784065 |
