CID 124253440

Tert-butyl n-[6-(aminomethyl)pyridazin-3-yl]carbamate

Structural Information

Molecular Formula
C10H16N4O2
SMILES
CC(C)(C)OC(=O)NC1=NN=C(C=C1)CN
InChI
InChI=1S/C10H16N4O2/c1-10(2,3)16-9(15)12-8-5-4-7(6-11)13-14-8/h4-5H,6,11H2,1-3H3,(H,12,14,15)
InChIKey
HBMNKSMCCWNPOP-UHFFFAOYSA-N
Compound name
tert-butyl N-[6-(aminomethyl)pyridazin-3-yl]carbamate
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

224.12732 Da
Monoisotopic Mass

-0.4
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 225.13460 150.7
[M+Na]+ 247.11654 159.9
[M+NH4]+ 242.16114 156.0
[M+K]+ 263.09048 156.4
[M-H]- 223.12004 150.5
[M+Na-2H]- 245.10199 155.4
[M]+ 224.12677 151.5
[M]- 224.12787 151.5
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.