| SpectraBase Spectrum ID |
E1zS0zxBbDo |
| Name |
Oroselone |
| CAS Registry Number |
1760-27-6 |
| 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 |
226.062994179 u |
| Formula |
C14H10O3 |
| 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/C14H10O3/c1-8(2)12-7-10-11(16-12)5-3-9-4-6-13(15)17-14(9)10/h3-7H,1H2,2H3 |
| InChIKey |
FQCPXIJRWHRHIP-UHFFFAOYSA-N |
| Molecular Weight |
226.231 g/mol |
| Nominal Mass |
226 u |
| Number of Peaks |
173 |
| SMILES |
CC(=C)c1cc2c3c(C=CC(O3)=O)ccc2o1 |
| SPLASH |
splash10-004j-5930000000-09fe6d09279d215c8a40 |
| Source of Spectrum |
Adams' Essential Oil Components (GC-MS), Version 4 |
| Wiley ID |
RA001066 |
