| SpectraBase Spectrum ID |
IQh7A3eNpMR |
| Name |
Rosmarinic acid, penta-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 |
720.282151430 u |
| Formula |
C33H56O8Si5 |
| GC Column |
HP-5ms (30 m × 0.25 mm ID x 0.25 μm film thickness) |
| InChI |
InChI=1S/C33H56O8Si5/c1-42(2,3)37-27-19-16-25(22-29(27)39-44(7,8)9)18-21-32(34)36-31(33(35)41-46(13,14)15)24-26-17-20-28(38-43(4,5)6)30(23-26)40-45(10,11)12/h16-23,31H,24H2,1-15H3/b21-18+ |
| InChIKey |
TUNDBMHTRNCQHX-DYTRJAOYSA-N |
| Molecular Weight |
721.228 g/mol |
| Nominal Mass |
720 u |
| Number of Peaks |
165 |
| SMILES |
c1c(c(cc(c1)\C=C\C(OC(Cc1cc(c(cc1)O[Si](C)(C)C)O[Si](C)(C)C)C(O[Si](C)(C)C)=O)=O)O[Si](C)(C)C)O[Si](C)(C)C |
| SPLASH |
splash10-0002-1019000000-0d8c790233be0642cad4 |
| Source |
Cayman Chemical |
| Source of Spectrum |
Biologically and Environmentally Important Organic Compounds: GCMS Library |
| Wiley ID |
VI001429 |
