| SpectraBase Spectrum ID |
3776cXw68gj |
| Name |
4-Hydroxy-6-methyl-2-methylsulfanyl-isophthalic acid 1-benzyl ester 3-methyl ester |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C18H18O5S |
| InChI |
InChI=1S/C18H18O5S/c1-11-9-13(19)15(17(20)22-2)16(24-3)14(11)18(21)23-10-12-7-5-4-6-8-12/h4-9,19H,10H2,1-3H3 |
| InChIKey |
ICEXUWWXVROSFP-UHFFFAOYSA-N |
| Molecular Weight |
346.397 g/mol |
| SMILES |
Oc1cc(c(c(c1C(=O)OC)SC)C(OCc1ccccc1)=O)C |
| SPLASH |
splash10-052f-7293000000-5fbee44d94b06d41c085 |
| Source of Spectrum |
F-69-6006-5ao |
| Synonyms |
Benzyl methyl 2-hydroxy-3-methyl-6-methylthio-isophthalate
1-Benzyl 3-methyl 4-hydroxy-6-methyl-2-(methylthio)isophthalate |
| Wiley ID |
1738345 |
