CID 17998779

(5-trimethylsilanylethynyl-pyridin-2-yl)-carbamic acid tert-butyl ester

Structural Information

Molecular Formula
C15H22N2O2Si
SMILES
CC(C)(C)OC(=O)NC1=NC=C(C=C1)C#C[Si](C)(C)C
InChI
InChI=1S/C15H22N2O2Si/c1-15(2,3)19-14(18)17-13-8-7-12(11-16-13)9-10-20(4,5)6/h7-8,11H,1-6H3,(H,16,17,18)
InChIKey
YGCSGXBHBYIJFY-UHFFFAOYSA-N
Compound name
tert-butyl N-[5-(2-trimethylsilylethynyl)pyridin-2-yl]carbamate
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

13
Patents

290.14505 Da
Monoisotopic Mass

None
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 291.15233 174.0
[M+Na]+ 313.13427 181.6
[M-H]- 289.13777 174.3
[M+NH4]+ 308.17887 187.0
[M+K]+ 329.10821 178.7
[M+H-H2O]+ 273.14231 161.0
[M+HCOO]- 335.14325 186.9
[M+CH3COO]- 349.15890 207.1
[M+Na-2H]- 311.11972 176.7
[M]+ 290.14450 170.0
[M]- 290.14560 170.0
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

Literature stripe

No literature data available for this compound.

Patent stripe

patents stripe