| SpectraBase Spectrum ID |
5V8FwX95k48 |
| Name |
Neoechinulin A,2TMS |
| Classification |
Chemical |
| Comments |
Spectrum verified by crosschecking against external libraries (one reference spectrum with similarity >= 99% found) |
| Copyright |
Copyright © 2024 DigiLab GmbH and Wiley-VCH GmbH. All Rights Reserved. |
| Exact Mass |
467.242430511 u |
| Formula |
C25H37N3O2Si2 |
| InChI |
InChI=1S/C25H37N3O2Si2/c1-11-25(3,4)22-19(18-14-12-13-15-21(18)28(22)32(8,9)10)16-20-24(30)27(31(5,6)7)17(2)23(29)26-20/h11-17H,1H2,2-10H3,(H,26,29)/b20-16-/t17-/m0/s1 |
| InChIKey |
VKCAIDCLFLAIKX-IMGOXIFKSA-N |
| Ionization Type |
Electron Ionization (EI) |
| Molecular Weight |
467.760 g/mol |
| Nominal Mass |
467 u |
| Quality |
985 |
| Retention Index |
3552 |
| SMILES |
C=1(N(C=2C(C1\C=C\1C(N([C@](C(N1)=O)(C)[H])[Si](C)(C)C)=O)=CC=CC2)[Si](C)(C)C)C(C=C)(C)C |
| SPLASH |
splash10-0uk9-3856900000-24d5b3696c9365a8d0cb |
| Source of Spectrum |
DigiLab GmbH (C) 2024 |
| Synonyms |
(3Z,6S)-6-Methyl-3-((2-(2-methylbut-3-en-2-yl)-1-(trimethylsilyl)-1H-indol-3-yl)methylidene)-1-\r(trimethylsilyl)piperazine-2,5-dione |
| Technique |
GC/MS |
| Wiley ID |
DD2024_030847 |
