| SpectraBase Spectrum ID |
JBPy7pYxJjF |
| Name |
Peucenin, 7-methyl ether |
| CAS Registry Number |
13544-40-6 |
| 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 |
274.120509056 u |
| Formula |
C16H18O4 |
| 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/C16H18O4/c1-9(2)5-6-11-13(19-4)8-14-15(16(11)18)12(17)7-10(3)20-14/h5,7-8,18H,6H2,1-4H3 |
| InChIKey |
ACFZPAPMLYYOCT-UHFFFAOYSA-N |
| Molecular Weight |
274.316 g/mol |
| Nominal Mass |
274 u |
| Number of Peaks |
130 |
| SMILES |
Oc1c2c(cc(c1CC=C(C)C)OC)OC(=CC2=O)C |
| SPLASH |
splash10-00lr-2190000000-7ce6a13b3a10512c4edd |
| Source |
ex VASU DEV |
| Source of Spectrum |
Adams' Essential Oil Components (GC-MS), Version 4 |
| Wiley ID |
RA001083 |
