CID 161417191

Tert-butyl 2-[(6-chloropyridin-2-yl)oxy]acetate

Structural Information

Molecular Formula
C11H14ClNO3
SMILES
CC(C)(C)OC(=O)COC1=NC(=CC=C1)Cl
InChI
InChI=1S/C11H14ClNO3/c1-11(2,3)16-10(14)7-15-9-6-4-5-8(12)13-9/h4-6H,7H2,1-3H3
InChIKey
ZQYSJGZTEROBSQ-UHFFFAOYSA-N
Compound name
tert-butyl 2-(6-chloropyridin-2-yl)oxyacetate
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

243.06622 Da
Monoisotopic Mass

3.0
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 244.07350 151.7
[M+Na]+ 266.05544 164.2
[M+NH4]+ 261.10004 158.7
[M+K]+ 282.02938 158.8
[M-H]- 242.05894 151.6
[M+Na-2H]- 264.04089 157.5
[M]+ 243.06567 153.7
[M]- 243.06677 153.7
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

No patent data available for this compound.