| SpectraBase Spectrum ID |
4UzerHFJwm |
| Name |
Abietatriene |
| CAS Registry Number |
19407-28-4 |
| 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 |
270.234750966 u |
| Formula |
C20H30 |
| 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/C20H30/c1-14(2)15-7-9-17-16(13-15)8-10-18-19(3,4)11-6-12-20(17,18)5/h7,9,13-14,18H,6,8,10-12H2,1-5H3/t18-,20+/m0/s1 |
| InChIKey |
QUUCYKKMFLJLFS-AZUAARDMSA-N |
| Molecular Weight |
270.460 g/mol |
| Nominal Mass |
270 u |
| Number of Peaks |
153 |
| SMILES |
C[C@]12c3c(CC[C@]2(C(C)(C)CCC1)[H])cc(cc3)C(C)C |
| SPLASH |
splash10-0abc-4930000000-2422f74975f323660391 |
| Source of Spectrum |
Adams' Essential Oil Components (GC-MS), Version 4 |
| Wiley ID |
RA000008 |
