SpectraBase Spectrum ID |
JsRETBphDGw |
Name |
Caffeic acid 3TMS @ |
CAS Registry Number |
10586-03-5 |
Classification |
Plant ingredient |
Copyright |
Copyright © 2023-2024 Wiley-VCH GmbH. All Rights Reserved. |
Exact Mass |
396.160839111 u |
Formula |
C18H32O4Si3 |
InChI |
InChI=1S/C18H32O4Si3/c1-23(2,3)20-16-12-10-15(14-17(16)21-24(4,5)6)11-13-18(19)22-25(7,8)9/h10-14H,1-9H3/b13-11+ |
InChIKey |
MBIYCWDFSLHMSI-ACCUITESSA-N |
Ionization Type |
Electron Ionization (EI) |
Molecular Weight |
396.705 g/mol |
SMILES |
c1(cc(\C=C\C(=O)O[Si](C)(C)C)ccc1O[Si](C)(C)C)O[Si](C)(C)C |
SPLASH |
splash10-00r2-6369000000-cfcbf49dffc74442107b |
Sample Comments |
The MMPW Reference Handbook and associated Tables are attached to Record #1, under the Attachments tab. Refer to these references for an explanation of the Sample Preparation Procedure "Detected" abbreviations, as well as other relevant information pertaining to this database. |
Source of Spectrum |
H.H.Maurer, M.Meyer, K.Pfleger, A.A. Weber / University of Saarland, D-66424 Homburg Germany |
Synonyms |
3,4-Dihydroxycinnamic acid 3TMS |
Technique |
GC/MS |
Wiley ID |
MMPW6e_6014 |