| SpectraBase Spectrum ID |
6G3vy6mv3Cf |
| Name |
12-Hydroxy-.beta.-isocaryophyllene |
| 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 |
220.182715392 u |
| Formula |
C15H24O |
| GC Column |
HP-5ms (30 m × 0.25 mm ID x 0.25 μm film thickness) |
| InChI |
InChI=1S/C15H24O/c1-11-5-4-6-12(10-16)7-8-14-13(11)9-15(14,2)3/h6,13-14,16H,1,4-5,7-10H2,2-3H3/b12-6+ |
| InChIKey |
MGIQTXDHQJGPEZ-WUXMJOGZSA-N |
| Molecular Weight |
220.356 g/mol |
| Nominal Mass |
220 u |
| Number of Peaks |
26 |
| SMILES |
OC\C=1CCC2C(C)(C)CC2C(CCC/1)=C |
| SPLASH |
splash10-0006-9300000000-61b7191551f91a4427ef |
| Source |
Betula pubescens buds; ex. A. Tkachev |
| Source of Spectrum |
Biologically and Environmentally Important Organic Compounds: GCMS Library |
| Wiley ID |
VI001200 |
