| SpectraBase Spectrum ID |
H7ZIGf3Fcw9 |
| Name |
9-Thioethyl-5-dibenzosuberanecarboxylic acid |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C18H16O2S |
| InChI |
InChI=1S/C18H16O2S/c1-2-21-18(17(19)20)15-9-5-3-7-13(15)11-12-14-8-4-6-10-16(14)18/h2-10H,1,11-12H2,(H,19,20) |
| InChIKey |
MQWMXZJTLRNRRD-UHFFFAOYSA-N |
| Molecular Weight |
296.384 g/mol |
| SMILES |
OC(C1(c2c(CCc3c1cccc3)cccc2)SC=C)=O |
| SPLASH |
splash10-000i-0970000000-414acf6eaffc7dd60097 |
| Source of Spectrum |
F-54-2255-1 |
| Synonyms |
5-Thioethyl-5-dibenzosuberanecarboxylic acid |
| Wiley ID |
806146 |
