| SpectraBase Spectrum ID |
4yCY3dO1OpZ |
| Name |
6-(1,1,4,4,7-pentamethyltetralin-6-yl)sulfanylpyridine-3-carboxylic acid |
| Alternate Name(s) |
6-[(1,1,4,4,7-pentamethyltetralin-6-yl)thio]nicotinic acid
6-[(3,5,5,8,8-pentamethyl-6,7-dihydronaphthalen-2-yl)sulfanyl]pyridine-3-carboxylic acid
6-[(3,5,5,8,8-pentamethyl-6,7-dihydronaphthalen-2-yl)thio]-3-pyridinecarboxylic acid |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C21H25NO2S |
| InChI |
InChI=1S/C21H25NO2S/c1-13-10-15-16(21(4,5)9-8-20(15,2)3)11-17(13)25-18-7-6-14(12-22-18)19(23)24/h6-7,10-12H,8-9H2,1-5H3,(H,23,24) |
| InChIKey |
PMHYUNDXKUCCIA-UHFFFAOYSA-N |
| Molecular Weight |
355.496 g/mol |
| SMILES |
OC(c1cnc(cc1)Sc1cc2c(cc1C)C(CCC2(C)C)(C)C)=O |
| SPLASH |
splash10-00dl-0009000000-1f5e9c20dff78b6ef64d |
| Source of Spectrum |
E1-39-3562-5 |
| Wiley ID |
1598953 |
