| SpectraBase Spectrum ID |
FEmDkT3JlwM |
| Name |
Acorenol |
| CAS Registry Number |
28296-85-7 |
| Copyright |
Database Compilation Copyright © 2023-2025 John Wiley and Sons, Inc. Copyright © 2023-2025 John Wiley and Sons, Inc., Portions Copyright Wiley-VCH GmbH, Adams Library under license from Diablo Analytical. All Rights Reserved. |
| Exact Mass |
222.198365456 u |
| Formula |
C15H26O |
| 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/C15H26O/c1-11-7-9-15(10-8-11)12(2)5-6-13(15)14(3,4)16/h7,12-13,16H,5-6,8-10H2,1-4H3/t12-,13+,15-/m1/s1 |
| InChIKey |
XDVDHFJMCJWDPI-VNHYZAJKSA-N |
| Molecular Weight |
222.372 g/mol |
| Nominal Mass |
222 u |
| Number of Peaks |
119 |
| SMILES |
OC([C@@]1(CC[C@]([C@]11CC=C(CC1)C)(C)[H])[H])(C)C |
| SPLASH |
splash10-05mo-9600000000-c321f23684a0c3270d0a |
| Source of Spectrum |
Adams' Essential Oil Components (GC-MS), Version 4 |
| Wiley ID |
RA000029 |
