| SpectraBase Spectrum ID |
3RxRwAYd5pq |
| Name |
Damascone<(E)-alpha-> |
| CAS Registry Number |
57549-92-5 |
| 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 |
192.151415263 u |
| Formula |
C13H20O |
| 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/C13H20O/c1-5-7-11(14)12-10(2)8-6-9-13(12,3)4/h5,7-8,12H,6,9H2,1-4H3/b7-5+ |
| InChIKey |
CRIGTVCBMUKRSL-FNORWQNLSA-N |
| Molecular Weight |
192.302 g/mol |
| Nominal Mass |
192 u |
| Number of Peaks |
107 |
| SMILES |
C1CC=C(C(C1(C)C)C(\C=C\C)=O)C |
| SPLASH |
splash10-014i-9100000000-bc77c569d22972fbbb12 |
| Source of Spectrum |
Adams' Essential Oil Components (GC-MS), Version 4 |
| Wiley ID |
RA000447 |
