| SpectraBase Spectrum ID |
EtZnWlP6vzF |
| Name |
Bourbonanone<1-nor-> |
| CAS Registry Number |
13844-03-6 |
| 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 |
206.167065327 u |
| Formula |
C14H22O |
| 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/C14H22O/c1-8(2)9-6-7-14(3)10-4-5-11(15)12(10)13(9)14/h8-10,12-13H,4-7H2,1-3H3/t9-,10+,12+,13+,14-/m0/s1 |
| InChIKey |
PYUWACLOPFTHBV-HNTFPEDGSA-N |
| Molecular Weight |
206.329 g/mol |
| Nominal Mass |
206 u |
| Number of Peaks |
98 |
| SMILES |
[C@]12([C@](C(=O)CC2)([C@@]2([C@]1(CC[C@]2(C(C)C)[H])C)[H])[H])[H] |
| SPLASH |
splash10-001i-9200000000-1ddbcb94e602ba46fed4 |
| Source of Spectrum |
Adams' Essential Oil Components (GC-MS), Version 4 |
| Wiley ID |
RA000197 |
