| SpectraBase Spectrum ID |
3f4XEiedtI |
| Name |
Methyl jasmonate |
| CAS Registry Number |
1211-29-6 |
| 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 |
224.141244501 u |
| Formula |
C13H20O3 |
| 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/C13H20O3/c1-3-4-5-6-11-10(7-8-12(11)14)9-13(15)16-2/h4-5,10-11H,3,6-9H2,1-2H3/b5-4-/t10-,11-/m1/s1 |
| InChIKey |
GEWDNTWNSAZUDX-WQMVXFAESA-N |
| Molecular Weight |
224.300 g/mol |
| Nominal Mass |
224 u |
| Number of Peaks |
126 |
| SMILES |
C1(CC[C@@]([C@]1(C\C=C/CC)[H])(CC(OC)=O)[H])=O |
| SPLASH |
splash10-053u-9300000000-aa034217fd49e0f3389e |
| Source of Spectrum |
Adams' Essential Oil Components (GC-MS), Version 4 |
| Wiley ID |
RA000949 |
