CID 1519344

(4-methoxy-pyridin-2-yl)-carbamic acid tert-butyl ester

Structural Information

Molecular Formula
C11H16N2O3
SMILES
CC(C)(C)OC(=O)NC1=NC=CC(=C1)OC
InChI
InChI=1S/C11H16N2O3/c1-11(2,3)16-10(14)13-9-7-8(15-4)5-6-12-9/h5-7H,1-4H3,(H,12,13,14)
InChIKey
APPULKDYZGWMNP-UHFFFAOYSA-N
Compound name
tert-butyl N-(4-methoxy-2-pyridinyl)carbamate
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

41
Patents

224.11609 Da
Monoisotopic Mass

1.7
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 225.123366 150.5
[M+Na]+ 247.105308 157.7
[M-H]- 223.108814 153.1
[M+NH4]+ 242.149913 167.5
[M+K]+ 263.079248 157.1
[M+H-H2O]+ 207.113350 143.7
[M+HCOO]- 269.114291 172.5
[M+CH3COO]- 283.129941 190.4
[M+Na-2H]- 245.090756 156.9
[M]+ 224.11554142 153.6
[M]- 224.11663858 153.6
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