| SpectraBase Spectrum ID |
1bi3WjHqt8S |
| Name |
Carbonic acid <3-hexenyl-, methyl-> ester |
| CAS Registry Number |
67633-96-9 |
| 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 |
158.094294308 u |
| Formula |
C8H14O3 |
| InChI |
InChI=1S/C8H14O3/c1-3-4-5-6-7-11-8(9)10-2/h4-5H,3,6-7H2,1-2H3/b5-4- |
| InChIKey |
BLOXMGXSDAAJGX-PLNGDYQASA-N |
| Molecular Weight |
158.197 g/mol |
| Number of Peaks |
47 |
| RI1 |
1092 |
| RI2 |
766 |
| RI3 |
886 |
| RI4 |
841 |
| SMILES |
C(\C=C/CC)COC(OC)=O |
| SPLASH |
splash10-014i-9000000000-d5c74c3754f39b2ff1bd |
| 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 |
Carbonic acid, (3Z)-3-hexenyl methyl ester |
| Wiley ID |
LM_FFNSC3_1314 |
