| SpectraBase Spectrum ID |
87dJAIRhX92 |
| Name |
Acetic acid <(3-methylbutoxy)-, 2-propenyl-> ester |
| CAS Registry Number |
67634-00-8 |
| 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 |
186.125594437 u |
| Formula |
C10H18O3 |
| InChI |
InChI=1S/C10H18O3/c1-4-6-13-10(11)8-12-7-5-9(2)3/h4,9H,1,5-8H2,2-3H3 |
| InChIKey |
XCWPXUNHSPOFGV-UHFFFAOYSA-N |
| Molecular Weight |
186.251 g/mol |
| Number of Peaks |
50 |
| RI1 |
1243 |
| RI2 |
921 |
| RI3 |
1043 |
| RI4 |
998 |
| SMILES |
C=CCOC(COCCC(C)C)=O |
| SPLASH |
splash10-0006-9000000000-e66674c8997bf9a7244b |
| 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 |
Acetic acid, (3-methylbutoxy)-, 2-propenyl ester |
| Wiley ID |
LM_FFNSC3_192 |
