| SpectraBase Spectrum ID |
7M6GRufiIVw |
| Name |
Bifloratriene |
| CAS Registry Number |
69636-81-3 |
| 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 |
286.266051095 u |
| Formula |
C21H34 |
| 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/C21H34/c1-15(2)8-7-9-17(4)20-13-11-18(5)19-12-10-16(3)14-21(19,20)6/h8,14,17,19-20H,5,7,9-13H2,1-4,6H3/t17?,19-,20-,21+/m0/s1 |
| InChIKey |
VZJURRAUAOXUNS-VAJWBBEOSA-N |
| Molecular Weight |
286.503 g/mol |
| Nominal Mass |
286 u |
| Number of Peaks |
176 |
| SMILES |
C=1(CC[C@@]2([C@@](C1)([C@@](CCC2=C)(C(C)CCC=C(C)C)[H])C)[H])C |
| SPLASH |
splash10-0abl-5910000000-7f87cc299eda08d80797 |
| Source of Spectrum |
Adams' Essential Oil Components (GC-MS), Version 4 |
| Wiley ID |
RA000168 |
