| SpectraBase Spectrum ID |
1ORwmiZtimv |
| Name |
Caryophyllene <6-hydroxy-.beta.-> p-coumarate, mono-TMS |
| 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 |
438.259021616 u |
| Formula |
C27H38O3Si |
| GC Column |
HP-5ms (30 m × 0.25 mm ID x 0.25 μm film thickness) |
| InChI |
InChI=1S/C27H38O3Si/c1-19-8-14-25-24(18-27(25,3)4)20(2)17-23(16-19)29-26(28)15-11-21-9-12-22(13-10-21)30-31(5,6)7/h9-13,15-16,23-25H,2,8,14,17-18H2,1,3-7H3/b15-11+,19-16+ |
| InChIKey |
SNBYPQQRSVCCCK-LIQIVELISA-N |
| Molecular Weight |
438.683 g/mol |
| Nominal Mass |
438 u |
| Number of Peaks |
208 |
| SMILES |
c1c(ccc(c1)\C=C\C(OC1\C=C\(CCC2C(C(C1)=C)CC2(C)C)C)=O)O[Si](C)(C)C |
| SPLASH |
splash10-014i-2290000000-52def33cec3ddef64f93 |
| Source |
birch (B. pubescens; B. litwinowii) buds; birch-type propolis |
| Source of Spectrum |
Biologically and Environmentally Important Organic Compounds: GCMS Library |
| Synonyms |
6-Hydroxy-.beta.-caryophyllene p-coumarate, mono-TMS |
| Wiley ID |
VI000347 |
