SpectraBase Spectrum ID |
In74jG90Ucb |
Name |
Ferruginol<6-keto-> |
CAS Registry Number |
70614-89-0 |
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 |
300.208930140 u |
Formula |
C20H28O2 |
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/C20H28O2/c1-12(2)14-9-13-10-17(22)18-19(3,4)7-6-8-20(18,5)15(13)11-16(14)21/h9,11-12,18,21H,6-8,10H2,1-5H3/t18-,20+/m0/s1 |
InChIKey |
BGVCOQAMEPLESK-AZUAARDMSA-N |
Molecular Weight |
300.442 g/mol |
Nominal Mass |
300 u |
Number of Peaks |
189 |
SMILES |
Oc1c(cc2c(c1)[C@@]1([C@@](C(C2)=O)(C(CCC1)(C)C)[H])C)C(C)C |
SPLASH |
splash10-0frl-4982000000-31256fdad33f67348052 |
Source of Spectrum |
Adams' Essential Oil Components (GC-MS), Version 4 |
Wiley ID |
RA000592 |