CID 131631788

N-[(oxolan-2-yl)methyl]pyridazin-4-amine

Structural Information

Molecular Formula
C9H13N3O
SMILES
C1CC(OC1)CNC2=CN=NC=C2
InChI
InChI=1S/C9H13N3O/c1-2-9(13-5-1)7-10-8-3-4-11-12-6-8/h3-4,6,9H,1-2,5,7H2,(H,10,11)
InChIKey
VACRFNXVJJFRBU-UHFFFAOYSA-N
Compound name
N-(oxolan-2-ylmethyl)pyridazin-4-amine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

179.10587 Da
Monoisotopic Mass

0.2
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 180.113146 136.9
[M+Na]+ 202.095088 142.7
[M-H]- 178.098594 140.9
[M+NH4]+ 197.139693 153.8
[M+K]+ 218.069028 141.8
[M+H-H2O]+ 162.103130 128.3
[M+HCOO]- 224.104071 158.5
[M+CH3COO]- 238.119721 149.3
[M+Na-2H]- 200.080536 144.2
[M]+ 179.10532142 134.4
[M]- 179.10641858 134.4
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.