| SpectraBase Spectrum ID |
KZLE3RdDPyT |
| Name |
Isoamyl acetate |
| CAS Registry Number |
123-92-2 |
| 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 |
130.099379689 u |
| Formula |
C7H14O2 |
| InChI |
InChI=1S/C7H14O2/c1-6(2)4-5-9-7(3)8/h6H,4-5H2,1-3H3 |
| InChIKey |
MLFHJEHSLIIPHL-UHFFFAOYSA-N |
| Molecular Weight |
130.187 g/mol |
| Number of Peaks |
50 |
| RI1 |
871 |
| RI2 |
535 |
| RI3 |
522 |
| RI4 |
474 |
| SMILES |
C(CC(C)C)OC(C)=O |
| SPLASH |
splash10-0006-9000000000-0c46a16d5d4f34915130 |
| 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 |
1-Butanol, 3-methyl-, acetate |
| Wiley ID |
LM_FFNSC3_1637 |
