| SpectraBase Spectrum ID |
CKOMT4Vr5Au |
| Name |
DOPA, 3TMS |
| Alternate Name(s) |
levodopa, 3TMS
L-dopa, 3TMS
Dopar, 3TMS
Brocadopa, 3TMS
Cidandopa, 3TMS
Insulamina, 3TMS
(2S)-2-amino-3-(3,4-dihydroxyphenyl)propanoic acid, 3TMS
Trimethylsilyl (S)-2-amino-3-(3,4-bis((trimethylsilyl)oxy)phenyl)propanoate |
| Comments |
Derivatization type: 3 TMS (mass: 413.187); CC-BY: Oliver Fiehn, University of California, Davis; MoNA-ID: FiehnLib000753; Note: The molecular formula of the structure shown is C9H11NO4 - which differs from the formula reported for the mass spectrum (C18H35NO4Si3) |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C18H35NO4Si3 |
| InChI |
InChI=1S/C18H35NO4Si3/c1-24(2,3)21-16-11-10-14(13-17(16)22-25(4,5)6)12-15(19)18(20)23-26(7,8)9/h10-11,13,15H,12,19H2,1-9H3/t15-/m0/s1 |
| InChIKey |
QFQPTDGWWJEVEK-HNNXBMFYSA-N |
| Molecular Weight |
413.736 g/mol |
| SMILES |
N[C@@](Cc1ccc(c(c1)O[Si](C)(C)C)O[Si](C)(C)C)(C(=O)O[Si](C)(C)C)[H] |
| SPLASH |
splash10-014i-1890000000-773081b815ef52751f2f |
| Source of Spectrum |
FM-2019-753-0 |
| Wiley ID |
1818429 |
