| SpectraBase Spectrum ID |
2B7tu6WJbU |
| Name |
Allo-cedrol |
| CAS Registry Number |
50657-30-2 |
| 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/c1-10-5-6-11-13(2,3)14(4)7-8-15(10,11)9-12(14)16/h10-12,16H,5-9H2,1-4H3/t10-,11+,12+,14+,15?/m1/s1 |
| InChIKey |
CSTOJISGDOIIDQ-VIQUFREZSA-N |
| Molecular Weight |
222.372 g/mol |
| Nominal Mass |
222 u |
| Number of Peaks |
142 |
| SMILES |
O[C@@]1([C@]2(C([C@]3(C(C1)([C@@](CC3)(C)[H])CC2)[H])(C)C)C)[H] |
| SPLASH |
splash10-00kg-8900000000-6cbd5afae37dda910388 |
| Source |
ex JUNIPERUS CHINENSIS WOOD, PENTANE EXT. |
| Source of Spectrum |
Adams' Essential Oil Components (GC-MS), Version 4 |
| Wiley ID |
RA000043 |
