| SpectraBase Spectrum ID |
b1WpR0BnUg |
| Name |
trans-2-Methyl-2-pentenoic acid |
| CAS Registry Number |
16957-70-3 |
| Copyright |
Database Compilation Copyright © 2023-2024 John Wiley and Sons, Inc. Copyright © 2023-2024 John Wiley and Sons, Inc., Portions Copyright Wiley-VCH GmbH, Adams Library under license from Diablo Analytical. All Rights Reserved. |
| Exact Mass |
114.068079560 u |
| Formula |
C6H10O2 |
| InChI |
InChI=1S/C6H10O2/c1-3-4-5(2)6(7)8/h4H,3H2,1-2H3,(H,7,8)/b5-4+ |
| InChIKey |
JJYWRQLLQAKNAD-SNAWJCMRSA-N |
| Molecular Weight |
114.144 g/mol |
| Number of Peaks |
50 |
| RI1 |
1037 |
| RI2 |
711 |
| RI3 |
1018 |
| RI4 |
974 |
| SMILES |
OC(\C(C)=C\CC)=O |
| SPLASH |
splash10-00kf-9000000000-d59e0fc70e77b73f794b |
| Sample Comments |
RI1: measured on SLB-5ms (Hydro)
RI2: measured on SLB-5ms (FAMEs)
RI3: measured on Supelcowax-10 (FAMEs)
RI4: measured on Supelcowax-10 (FAEEs)
RI5: measured on Equity-1 (Hydro) |
| Source of Spectrum |
Prof. L. Mondello (Chromaleont s.r.l./Univ. Messina, Italy) |
| Synonyms |
2-Pentenoic acid, 2-methyl-, (2E)- |
| Wiley ID |
LM_FFNSC3_2991 |
