CID 11117822

Methyl 4-((tert-butyldimethylsilyl)oxy)but-2-ynoate

Structural Information

Molecular Formula
C11H20O3Si
SMILES
CC(C)(C)[Si](C)(C)OCC#CC(=O)OC
InChI
InChI=1S/C11H20O3Si/c1-11(2,3)15(5,6)14-9-7-8-10(12)13-4/h9H2,1-6H3
InChIKey
AZZKYIBYBIUUTC-UHFFFAOYSA-N
Compound name
methyl 4-[tert-butyl(dimethyl)silyl]oxybut-2-ynoate
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

9
Patents

228.11816 Da
Monoisotopic Mass

None
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 229.12544 153.7
[M+Na]+ 251.10738 161.9
[M-H]- 227.11088 153.4
[M+NH4]+ 246.15198 170.9
[M+K]+ 267.08132 161.4
[M+H-H2O]+ 211.11542 143.5
[M+HCOO]- 273.11636 167.4
[M+CH3COO]- 287.13201 195.2
[M+Na-2H]- 249.09283 157.2
[M]+ 228.11761 152.7
[M]- 228.11871 152.7
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

Literature stripe

literature stripe

Patent stripe

patents stripe