| SpectraBase Spectrum ID |
JXXcw01e33I |
| Name |
Isobazzanene |
| CAS Registry Number |
88661-59-0 |
| 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 |
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/c1-12-7-10-15(4,11-8-12)13-6-5-9-14(13,2)3/h6-7H,5,8-11H2,1-4H3/t15-/m0/s1 |
| InChIKey |
WUOZOSFJWTXTKG-HNNXBMFYSA-N |
| Molecular Weight |
204.357 g/mol |
| Nominal Mass |
204 u |
| Number of Peaks |
92 |
| SMILES |
C1=C(CC[C@](C1)(C1=CCCC1(C)C)C)C |
| SPLASH |
splash10-00du-5900000000-9f0012a767b09b61b206 |
| Source |
ex BAZZANIA TRILOBATA ex KOENIG |
| Source of Spectrum |
Adams' Essential Oil Components (GC-MS), Version 4 |
| Wiley ID |
RA000728 |
