| SpectraBase Spectrum ID |
43tCGAkW0Zv |
| Name |
Acetyl isovaleryl |
| Source of Sample |
Penta Manifacturing Prod. code 01-08300 |
| CAS Registry Number |
13706-86-0 |
| 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 |
128.083729624 u |
| Formula |
C7H12O2 |
| InChI |
InChI=1S/C7H12O2/c1-5(2)4-7(9)6(3)8/h5H,4H2,1-3H3 |
| InChIKey |
PQCLJXVUAWLNSV-UHFFFAOYSA-N |
| Molecular Weight |
128.171 g/mol |
| Number of Peaks |
50 |
| RI1 |
834 |
| RI2 |
539 |
| RI3 |
573 |
| RI4 |
500 |
| SMILES |
CC(CC(C(C)=O)=O)C |
| SPLASH |
splash10-052f-9000000000-fb016fc3be05f376fad3 |
| 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 |
2,3-Hexanedione, 5-methyl- |
| Wiley ID |
LM_FFNSC3_2977 |
