| SpectraBase Spectrum ID |
DRLWHvxMIib |
| Name |
Cedryl methyl ketone |
| CAS Registry Number |
68039-35-0 |
| 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 |
246.198365456 u |
| Formula |
C17H26O |
| 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/C17H26O/c1-10-6-7-15-16(4,5)14-9-17(10,15)8-13(11(14)2)12(3)18/h10,14-15H,6-9H2,1-5H3/t10-,14+,15+,17+/m1/s1 |
| InChIKey |
YBUIAJZFOGJGLJ-SWRJLBSHSA-N |
| Molecular Weight |
246.394 g/mol |
| Nominal Mass |
246 u |
| Number of Peaks |
155 |
| SMILES |
[C@]12([H])C([C@]3(C[C@]1([C@](C)(CC2)[H])CC(=C3C)C(=O)C)[H])(C)C |
| SPLASH |
splash10-0006-9610000000-5948f6e313c060c57ffc |
| Source of Spectrum |
Adams' Essential Oil Components (GC-MS), Version 4 |
| Wiley ID |
RA000316 |
