| SpectraBase Spectrum ID |
87yLQX3SA1 |
| Name |
Caryophyllene <14-Hydroxy-.beta.-> p-coumarate |
| 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 |
366.219494823 u |
| Formula |
C24H30O3 |
| GC Column |
HP-5ms (30 m × 0.25 mm ID x 0.25 μm film thickness) |
| InChI |
InChI=1S/C24H30O3/c1-17-5-4-6-19(9-13-22-21(17)15-24(22,2)3)16-27-23(26)14-10-18-7-11-20(25)12-8-18/h6-8,10-12,14,21-22,25H,1,4-5,9,13,15-16H2,2-3H3/b14-10+,19-6- |
| InChIKey |
MLEJGSMEOLATTB-RZZXNRMTSA-N |
| Molecular Weight |
366.501 g/mol |
| Nominal Mass |
366 u |
| Number of Peaks |
111 |
| SMILES |
Oc1ccc(cc1)\C=C\C(OC\C=1CCC2C(C(CCC\1)=C)CC2(C)C)=O |
| SPLASH |
splash10-00kb-2900000000-5b74214b8e1ff17c96dc |
| Source |
Betula litwinowii buds |
| Source of Spectrum |
Biologically and Environmentally Important Organic Compounds: GCMS Library |
| Synonyms |
14-Hydroxy-.beta.-caryophyllene p-coumarate |
| Wiley ID |
VI000206 |
