| SpectraBase Spectrum ID |
AgYPjVrCpAI |
| Name |
Pimaradiene |
| CAS Registry Number |
1686-61-9 |
| 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 |
272.250401030 u |
| Formula |
C20H32 |
| 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/C20H32/c1-6-19(4)13-10-16-15(14-19)8-9-17-18(2,3)11-7-12-20(16,17)5/h6,14,16-17H,1,7-13H2,2-5H3/t16-,17-,19+,20+/m0/s1 |
| InChIKey |
XDSYKASBVOZOAG-RAUXBKROSA-N |
| Molecular Weight |
272.476 g/mol |
| Nominal Mass |
272 u |
| Number of Peaks |
193 |
| SMILES |
C1CC([C@]2([C@](C1)([C@@]1(C(CC2)=C[C@](CC1)(C)C=C)[H])C)[H])(C)C |
| SPLASH |
splash10-052u-6920000000-819606e2ac72e7947c7a |
| Source of Spectrum |
Adams' Essential Oil Components (GC-MS), Version 4 |
| Wiley ID |
RA001118 |
