| SpectraBase Spectrum ID |
4Gj8UlYMHoB |
| Name |
Manool |
| CAS Registry Number |
596-85-0 |
| 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 |
290.260965714 u |
| Formula |
C20H34O |
| 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/C20H34O/c1-7-19(5,21)14-11-16-15(2)9-10-17-18(3,4)12-8-13-20(16,17)6/h7,16-17,21H,1-2,8-14H2,3-6H3/t16-,17-,19-,20+/m1/s1 |
| InChIKey |
CECREIRZLPLYDM-LFGUQSLTSA-N |
| Molecular Weight |
290.491 g/mol |
| Nominal Mass |
290 u |
| Number of Peaks |
219 |
| SMILES |
O[C@@](CC[C@]1([C@@]2(C)[C@@](C(C)(C)CCC2)(CCC1=C)[H])[H])(C=C)C |
| SPLASH |
splash10-0006-9610000000-80e3eccdba27c9f498d1 |
| Source of Spectrum |
Adams' Essential Oil Components (GC-MS), Version 4 |
| Wiley ID |
RA000876 |
