| SpectraBase Spectrum ID |
EbmHux2M8W8 |
| Name |
Patchenol |
| CAS Registry Number |
58437-72-2 |
| 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 |
166.135765199 u |
| Formula |
C11H18O |
| 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/C11H18O/c1-11(2)9-4-3-8(7-9)10(11)5-6-12/h5,8-9,12H,3-4,6-7H2,1-2H3/b10-5-/t8-,9+/m0/s1 |
| InChIKey |
JGDHOHFQJJATNG-BWGNNSGVSA-N |
| Molecular Weight |
166.264 g/mol |
| Nominal Mass |
166 u |
| Number of Peaks |
88 |
| SMILES |
OC\C=C/1C([C@@]2(CC[C@]1(C2)[H])[H])(C)C |
| SPLASH |
splash10-052f-9300000000-2f2f053b266e8d330db8 |
| Source of Spectrum |
Adams' Essential Oil Components (GC-MS), Version 4 |
| Wiley ID |
RA001073 |
