| SpectraBase Spectrum ID |
CBb1sr4Jb6H |
| Name |
2-Pentenoic-3-d acid, 2-(1-methylethenyl)-, (E)- |
| CAS Registry Number |
125635-99-6 |
| Comments |
Removed - expert review: contamination (CH2Cl2); A corrected record has been addded having SpectrumID: 1821075 |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C8H11DO2 |
| InChI |
InChI=1S/C8H12O2/c1-4-5-7(6(2)3)8(9)10/h5H,2,4H2,1,3H3,(H,9,10)/b7-5+/i5D |
| InChIKey |
LRQLGGWBWJGZSZ-WCOCUMAXSA-N |
| Molecular Weight |
141.188 g/mol |
| SMILES |
OC(\C(C(=C)C)=C\(CC)[D])=O |
| SPLASH |
splash10-001r-9100000000-9e7b358b69074be7596e |
| Source of Spectrum |
B-42-477-10 |
| Synonyms |
3-Deuterio-2-(1-methylethenyl)-2-pentenoic acid |
| Wiley ID |
1139483 |
