| SpectraBase Spectrum ID |
LHbLtB6O1E2 |
| Name |
5-(4-Oxo-4,5,6,7-tetrahydro-1-benzothien-2-yl)pentanoic acid |
| CAS Registry Number |
58631-78-0 |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C13H16O3S |
| InChI |
InChI=1S/C13H16O3S/c14-11-5-3-6-12-10(11)8-9(17-12)4-1-2-7-13(15)16/h8H,1-7H2,(H,15,16) |
| InChIKey |
NXSAFLSWUOKALI-UHFFFAOYSA-N |
| Molecular Weight |
252.328 g/mol |
| SMILES |
OC(CCCCc1cc2c(s1)CCCC2=O)=O |
| SPLASH |
splash10-016r-3920000000-d131fa46b4fa285d2d80 |
| Source of Spectrum |
AD-0-2532-0 |
| Synonyms |
5-(4-keto-6,7-dihydro-5H-benzothiophen-2-yl)valeric acid
5-(4-oxidanylidene-6,7-dihydro-5H-1-benzothiophen-2-yl)pentanoic acid
5-(4-oxo-6,7-dihydro-5H-1-benzothiophen-2-yl)pentanoic acid
5-(4-oxo-6,7-dihydro-5H-benzothiophen-2-yl)pentanoic acid
Pentanoic acid, 5-(4,5,6,7-tetrahydro-4-oxo-2-benzothienyl)- |
| Wiley ID |
1425264 |
