| SpectraBase Spectrum ID |
K5WDH6HcVMq |
| Name |
Benzoic acid, 2-hydroxy-4-methoxy-6-(2-oxopentyl)- |
| Alternate Name(s) |
2-Hydroxy-4-methoxy-6-(2-oxopentyl)benzoic acid |
| CAS Registry Number |
127743-37-7 |
| Comments |
Less than 3 mono-isotopic peaks |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C13H16O5 |
| InChI |
InChI=1S/C13H16O5/c1-3-4-9(14)5-8-6-10(18-2)7-11(15)12(8)13(16)17/h6-7,15H,3-5H2,1-2H3,(H,16,17) |
| InChIKey |
FAAYWDIYAYMYHC-UHFFFAOYSA-N |
| Molecular Weight |
252.266 g/mol |
| SMILES |
Oc1cc(cc(c1C(=O)O)CC(=O)CCC)OC |
| SPLASH |
splash10-03di-0930000000-628117b32fe4e245bbba |
| Source of Spectrum |
B-42-1977-25 |
| Wiley ID |
1255366 |
