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]+ 180.11315 136.9
[M+Na]+ 202.09509 142.7
[M-H]- 178.09859 140.9
[M+NH4]+ 197.13969 153.8
[M+K]+ 218.06903 141.8
[M+H-H2O]+ 162.10313 128.3
[M+HCOO]- 224.10407 158.5
[M+CH3COO]- 238.11972 149.3
[M+Na-2H]- 200.08054 144.2
[M]+ 179.10532 134.4
[M]- 179.10642 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.