| SpectraBase Spectrum ID |
1A7Zvl0Bo0x |
| Name |
Bourbonene |
| CAS Registry Number |
5208-59-3 |
| 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 |
204.187800773 u |
| Formula |
C15H24 |
| 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/C15H24/c1-9(2)11-7-8-15(4)12-6-5-10(3)13(12)14(11)15/h9,11-14H,3,5-8H2,1-2,4H3/t11-,12+,13-,14+,15-/m0/s1 |
| InChIKey |
YIRAHEODBQONHI-ZQNQSHIBSA-N |
| Molecular Weight |
204.357 g/mol |
| Nominal Mass |
204 u |
| Number of Peaks |
112 |
| SMILES |
[C@@]12(CCC([C@@]2([C@@]2([C@]1(CC[C@]2(C(C)C)[H])C)[H])[H])=C)[H] |
| SPLASH |
splash10-0089-9600000000-73fa5837001b1b657353 |
| Source of Spectrum |
Adams' Essential Oil Components (GC-MS), Version 4 |
| Wiley ID |
RA000198 |
