| SpectraBase Spectrum ID |
1USwJSJUryL |
| Name |
Epoxy-pseudoisoeugenyl isobutyrate |
| CAS Registry Number |
137591-61-8 |
| 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 |
250.120509056 u |
| Formula |
C14H18O4 |
| 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/C14H18O4/c1-8(2)14(15)18-11-6-5-10(7-12(11)16-4)13-9(3)17-13/h5-9,13H,1-4H3 |
| InChIKey |
MCVNHWFLEYXICF-UHFFFAOYSA-N |
| Molecular Weight |
250.294 g/mol |
| Nominal Mass |
250 u |
| Number of Peaks |
95 |
| SMILES |
COc1c(ccc(c1)C1C(C)O1)OC(C(C)C)=O |
| SPLASH |
splash10-000f-9800000000-9d9460c0bf23d9615516 |
| Source |
ex PIMPINELLA PEREGRINA ROOTS, ex KUBECZKA |
| Source of Spectrum |
Adams' Essential Oil Components (GC-MS), Version 4 |
| Wiley ID |
RA000526 |
