CID 112693082

6-(3-methylbutoxy)pyridazin-3-amine

Structural Information

Molecular Formula
C9H15N3O
SMILES
CC(C)CCOC1=NN=C(C=C1)N
InChI
InChI=1S/C9H15N3O/c1-7(2)5-6-13-9-4-3-8(10)11-12-9/h3-4,7H,5-6H2,1-2H3,(H2,10,11)
InChIKey
DZNSGAHVWLZPJL-UHFFFAOYSA-N
Compound name
6-(3-methylbutoxy)pyridazin-3-amine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

181.1215 Da
Monoisotopic Mass

1.5
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 182.12878 140.9
[M+Na]+ 204.11072 148.2
[M-H]- 180.11422 141.4
[M+NH4]+ 199.15532 157.9
[M+K]+ 220.08466 146.6
[M+H-H2O]+ 164.11876 133.2
[M+HCOO]- 226.11970 162.6
[M+CH3COO]- 240.13535 184.8
[M+Na-2H]- 202.09617 146.6
[M]+ 181.12095 141.3
[M]- 181.12205 141.3
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.