SpectraBase Spectrum ID |
B13vgYFPGvA |
Name |
Protocatechoic acid 3TBDMS |
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 |
496.286039627 u |
Formula |
C25H48O4Si3 |
InChI |
InChI=1S/C25H48O4Si3/c1-23(2,3)30(10,11)27-20-17-16-19(22(26)29-32(14,15)25(7,8)9)18-21(20)28-31(12,13)24(4,5)6/h16-18H,1-15H3 |
InChIKey |
JCJACHCJNGAAAR-UHFFFAOYSA-N |
Ionization Type |
Electron Ionization (EI) |
Molecular Weight |
496.910 g/mol |
Nominal Mass |
496 u |
Quality |
874 |
Retention Index |
3423 |
SMILES |
C=1(C(O[Si](C(C)(C)C)(C)C)=CC=C(C(O[Si](C(C)(C)C)(C)C)=O)C1)O[Si](C(C)(C)C)(C)C |
SPLASH |
splash10-007c-4322900000-285147b8a21a37f477bd |
Source of Spectrum |
DigiLab GmbH (C) 2024 |
Synonyms |
tert-butyl(dimethyl)silyl 3,4-bis((tert-butyl(dimethyl)silyl)oxy)benzoate |
Technique |
GC/MS |
Wiley ID |
DD2024_024941 |