| SpectraBase Spectrum ID |
1vBlf901PRf |
| Name |
(R/S)-2-Cyano-2-methyl-3-(4'-methoxyphenyl)propanoic acid |
| Comments |
Less than 3 mono-isotopic peaks |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C12H13NO3 |
| InChI |
InChI=1S/C12H13NO3/c1-12(8-13,11(14)15)7-9-3-5-10(16-2)6-4-9/h3-6H,7H2,1-2H3,(H,14,15)/t12-/m1/s1 |
| InChIKey |
AOJILWYNXPPWFB-GFCCVEGCSA-N |
| Molecular Weight |
219.240 g/mol |
| SMILES |
OC([C@@](C#N)(Cc1ccc(cc1)OC)C)=O |
| SPLASH |
splash10-00di-0900000000-234b857d7d060b5e2182 |
| Source of Spectrum |
KD-14-2140-3 |
| Synonyms |
(2R)-2-cyano-3-(4-methoxyphenyl)-2-methylpropanoic acid |
| Wiley ID |
1636140 |
