| SpectraBase Spectrum ID |
7bT3IbCuzKP |
| Name |
(2S,3R)-2-Ethyl-3,4-dimethyl-4-pentenoic acid |
| Comments |
Less than 3 mono-isotopic peaks |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C9H16O2 |
| InChI |
InChI=1S/C9H16O2/c1-5-8(9(10)11)7(4)6(2)3/h7-8H,2,5H2,1,3-4H3,(H,10,11)/t7-,8-/m0/s1 |
| InChIKey |
SQVFZGYMKLQWLJ-YUMQZZPRSA-N |
| Molecular Weight |
156.225 g/mol |
| SMILES |
OC([C@]([C@](C(=C)C)(C)[H])(CC)[H])=O |
| SPLASH |
splash10-0006-9000000000-fa078c17f2835361538a |
| Source of Spectrum |
J-62-4448-10 |
| Synonyms |
(2S,3R)-2-ethyl-3,4-dimethyl-pent-4-enoic acid |
| Wiley ID |
1153899 |
