| SpectraBase Spectrum ID |
839O8czG61j |
| Name |
Arbusculone |
| CAS Registry Number |
56469-36-4 |
| 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 |
154.099379689 u |
| Formula |
C9H14O2 |
| 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/C9H14O2/c1-4-9(3)6-5-8(11-9)7(2)10/h4,8H,1,5-6H2,2-3H3/t8-,9-/m1/s1 |
| InChIKey |
FBFSXARBCWGXJL-RKDXNWHRSA-N |
| Molecular Weight |
154.209 g/mol |
| Nominal Mass |
154 u |
| Number of Peaks |
94 |
| SMILES |
C(C)([C@@]1(O[C@](CC1)(C)C=C)[H])=O |
| SPLASH |
splash10-0006-9100000000-53d2adfda7ee519bdb6e |
| Source of Spectrum |
Adams' Essential Oil Components (GC-MS), Version 4 |
| Wiley ID |
RA000102 |
