| SpectraBase Spectrum ID |
YzmnVT1KF8 |
| Name |
Caffeoyl-6-glucoside, hexa-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 |
774.332242906 u |
| Formula |
C33H66O9Si6 |
| GC Column |
HP-5ms (30 m × 0.25 mm ID x 0.25 μm film thickness) |
| InChI |
InChI=1S/C33H66O9Si6/c1-43(2,3)37-26-21-19-25(23-27(26)38-44(4,5)6)20-22-29(34)35-24-28-30(39-45(7,8)9)31(40-46(10,11)12)32(41-47(13,14)15)33(36-28)42-48(16,17)18/h19-23,28,30-33H,24H2,1-18H3/b22-20+ |
| InChIKey |
JXURTXXSSHNAMF-LSDHQDQOSA-N |
| Molecular Weight |
775.392 g/mol |
| Nominal Mass |
774 u |
| Number of Peaks |
133 |
| SMILES |
c1(c(ccc(c1)\C=C\C(OCC1OC(O[Si](C)(C)C)C(C(C1O[Si](C)(C)C)O[Si](C)(C)C)O[Si](C)(C)C)=O)O[Si](C)(C)C)O[Si](C)(C)C |
| SPLASH |
splash10-06di-2279000000-080d5b0272a3d68e20e2 |
| Source |
J. Nazaruk, Bellis perennis flowers |
| Source of Spectrum |
Biologically and Environmentally Important Organic Compounds: GCMS Library |
| Synonyms |
(E)-Caffeoyl-.beta.-D-6'-glucoside, hexa-TMS |
| Wiley ID |
VI001506 |
