SpectraBase Spectrum ID |
JHWdauUmKie |
Name |
(E)-2-Methyl-2-butenoic acid TMS |
CAS Registry Number |
55517-33-4 |
Classification |
Chemical |
Comments |
Spectrum verified by crosschecking against external libraries (two reference spectrum with similarity >= 99% found) |
Copyright |
Copyright © 2024 DigiLab GmbH and Wiley-VCH GmbH. All Rights Reserved. |
Exact Mass |
172.091956288 u |
Formula |
C8H16O2Si |
InChI |
InChI=1S/C8H16O2Si/c1-6-7(2)8(9)10-11(3,4)5/h6H,1-5H3/b7-6+ |
InChIKey |
GZQWHCAXPCOMTD-VOTSOKGWSA-N |
Ionization Type |
Electron Ionization (EI) |
Molecular Weight |
172.299 g/mol |
Nominal Mass |
172 u |
Quality |
997 |
Retention Index |
1149 |
SMILES |
C(O[Si](C)(C)C)(\C(=C\C)C)=O |
SPLASH |
splash10-0a4i-9500000000-3a6536a87f12e19e8272 |
Source of Spectrum |
DigiLab GmbH (C) 2024 |
Synonyms |
trimethylsilyl (2E)-2-methylbut-2-enoate |
Technique |
GC/MS |
Wiley ID |
DD2024_008413 |