| SpectraBase Spectrum ID |
20k0w5q18kU |
| Name |
Isovalerate <2-methylbutyl-> |
| Source of Sample |
SAFC Cat.no. W350605 |
| CAS Registry Number |
2445-77-4 |
| 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 |
172.146329882 u |
| Formula |
C10H20O2 |
| InChI |
InChI=1S/C10H20O2/c1-5-9(4)7-12-10(11)6-8(2)3/h8-9H,5-7H2,1-4H3 |
| InChIKey |
CYGPPWVXOWCHJB-UHFFFAOYSA-N |
| Molecular Weight |
172.268 g/mol |
| Number of Peaks |
50 |
| RI1 |
1109 |
| RI2 |
785 |
| RI3 |
707 |
| RI4 |
661 |
| SMILES |
CCC(COC(CC(C)C)=O)C |
| SPLASH |
splash10-05g3-9000000000-f2b48dd120510f2fb56f |
| 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 |
Butanoic acid, 3-methyl-, 2-methylbutyl ester |
| Wiley ID |
LM_FFNSC3_608 |
