| SpectraBase Spectrum ID |
4zwEoMW9kO |
| Name |
Butanoate<3-methylpentyl, 3-methyl-> |
| CAS Registry Number |
83783-89-5 |
| Copyright |
Database Compilation Copyright © 2023-2025 John Wiley and Sons, Inc. Copyright © 2023-2025 John Wiley and Sons, Inc., Portions Copyright Wiley-VCH GmbH, Adams Library under license from Diablo Analytical. All Rights Reserved. |
| Exact Mass |
186.161979946 u |
| Formula |
C11H22O2 |
| GC Column |
J&W DB-5 (30 m x 0.25 mm ID x 0.25 μm film thickness) |
| GC Oven Program |
60 °C to 246 °C at 3 °C/min. |
| InChI |
InChI=1S/C11H22O2/c1-5-9(3)7-8-13-11(12)10(4)6-2/h9-10H,5-8H2,1-4H3 |
| InChIKey |
OGFNJVCHDZQOND-UHFFFAOYSA-N |
| Molecular Weight |
186.295 g/mol |
| Nominal Mass |
186 u |
| Number of Peaks |
48 |
| SMILES |
C(C(C(OCCC(CC)C)=O)C)C |
| SPLASH |
splash10-052f-9100000000-b135916377910cb00d65 |
| Source |
ex LOMATIUM DISSECTIUM ROOTS |
| Source of Spectrum |
Adams' Essential Oil Components (GC-MS), Version 4 |
| Wiley ID |
RA000203 |
