| SpectraBase Spectrum ID |
3WmnkvGlGre |
| Name |
4-[2'-(3'',5''-Dimethylisoxazol-4''-yl)carbonyl]-phenylbutyric acid |
| Alternate Name(s) |
4-{2-[(3,5-dimethyl-4-isoxazolyl)carbonyl]phenyl}butanoic acid |
| Comments |
Less than 3 mono-isotopic peaks |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C16H17NO4 |
| InChI |
InChI=1S/C16H17NO4/c1-10-15(11(2)21-17-10)16(20)13-8-4-3-6-12(13)7-5-9-14(18)19/h3-4,6,8H,5,7,9H2,1-2H3,(H,18,19) |
| InChIKey |
SENRNRDDGVOCTD-UHFFFAOYSA-N |
| Molecular Weight |
287.315 g/mol |
| SMILES |
OC(CCCc1c(C(c2c(onc2C)C)=O)cccc1)=O |
| SPLASH |
splash10-0006-9000000000-2a143b1ed854e9cdb0ac |
| Source of Spectrum |
Y4-84-331-9 |
| Wiley ID |
1550126 |
![4-[2'-(3'',5''-Dimethylisoxazol-4''-yl)carbonyl]-phenylbutyric acid](/api/spectrum/3WmnkvGlGre/structure.png?h=300&w=458 "4-[2'-(3'',5''-Dimethylisoxazol-4''-yl)carbonyl]-phenylbutyric acid")
