| SpectraBase Spectrum ID |
3AIltd676sm |
| Name |
Neryl (E)-caffeate, di-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 |
460.246512834 u |
| Formula |
C25H40O4Si2 |
| GC Column |
HP-5ms (30 m × 0.25 mm ID x 0.25 μm film thickness) |
| InChI |
InChI=1S/C25H40O4Si2/c1-20(2)11-10-12-21(3)17-18-27-25(26)16-14-22-13-15-23(28-30(4,5)6)24(19-22)29-31(7,8)9/h11,13-17,19H,10,12,18H2,1-9H3/b16-14+,21-17+ |
| InChIKey |
ZACVVBSYNODOKZ-BKKRHBAOSA-N |
| Molecular Weight |
460.761 g/mol |
| Nominal Mass |
460 u |
| Number of Peaks |
55 |
| SMILES |
c1c(c(cc(c1)\C=C\C(=O)OC\C=C\(CCC=C(C)C)C)O[Si](C)(C)C)O[Si](C)(C)C |
| SPLASH |
splash10-0603-9245100000-c5088479738b023609ad |
| Source |
P. Walejko |
| Source of Spectrum |
Biologically and Environmentally Important Organic Compounds: GCMS Library |
| Wiley ID |
VI000209 |
