CID 45076485

501907-61-5

Structural Information

Molecular Formula
C10H12Cl2N2O2
SMILES
CC(C)(C)OC(=O)NC1=CC(=NC(=C1)Cl)Cl
InChI
InChI=1S/C10H12Cl2N2O2/c1-10(2,3)16-9(15)13-6-4-7(11)14-8(12)5-6/h4-5H,1-3H3,(H,13,14,15)
InChIKey
DEEVITBIJFESEP-UHFFFAOYSA-N
Compound name
tert-butyl N-(2,6-dichloropyridin-4-yl)carbamate
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

48
Patents

262.0276 Da
Monoisotopic Mass

3.3
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 263.03488 155.1
[M+Na]+ 285.01682 167.8
[M+NH4]+ 280.06142 162.3
[M+K]+ 300.99076 161.9
[M-H]- 261.02032 155.7
[M+Na-2H]- 283.00227 160.8
[M]+ 262.02705 157.6
[M]- 262.02815 157.6
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