| SpectraBase Spectrum ID |
Bf4B8aSiFa1 |
| Name |
2-[3-[(E)-3-keto-3-methoxy-prop-1-enyl]phenyl]acetic acid |
| Alternate Name(s) |
2-[3-[(E)-3-methoxy-3-oxidanylidene-prop-1-enyl]phenyl]ethanoic acid
2-[3-[(E)-3-methoxy-3-oxo-prop-1-enyl]phenyl]acetic acid |
| Comments |
Less than 3 mono-isotopic peaks |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C12H12O4 |
| InChI |
InChI=1S/C12H12O4/c1-16-12(15)6-5-9-3-2-4-10(7-9)8-11(13)14/h2-7H,8H2,1H3,(H,13,14)/b6-5+ |
| InChIKey |
ASKQHKWLWIRJFV-AATRIKPKSA-N |
| Molecular Weight |
220.224 g/mol |
| SMILES |
OC(Cc1cc(ccc1)\C=C\C(=O)OC)=O |
| SPLASH |
splash10-0006-0930000000-65f6f5ba40fbd9c201d8 |
| Source of Spectrum |
H1-37-1870-10 |
| Wiley ID |
755905 |
![2-[3-[(E)-3-keto-3-methoxy-prop-1-enyl]phenyl]acetic acid](/api/spectrum/Bf4B8aSiFa1/structure.png?h=300&w=458 "2-[3-[(E)-3-keto-3-methoxy-prop-1-enyl]phenyl]acetic acid")
