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-methoxypyridin-2-yl)carbamate
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

46
Patents

224.11609 Da
Monoisotopic Mass

1.7
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 225.12337 150.5
[M+Na]+ 247.10531 157.7
[M-H]- 223.10881 153.1
[M+NH4]+ 242.14991 167.5
[M+K]+ 263.07925 157.1
[M+H-H2O]+ 207.11335 143.7
[M+HCOO]- 269.11429 172.5
[M+CH3COO]- 283.12994 190.4
[M+Na-2H]- 245.09076 156.9
[M]+ 224.11554 153.6
[M]- 224.11664 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