CID 63557208

6-(oxolan-3-yloxy)pyridin-3-amine

Structural Information

Molecular Formula
C9H12N2O2
SMILES
C1COCC1OC2=NC=C(C=C2)N
InChI
InChI=1S/C9H12N2O2/c10-7-1-2-9(11-5-7)13-8-3-4-12-6-8/h1-2,5,8H,3-4,6,10H2
InChIKey
BAGALONVKVPJML-UHFFFAOYSA-N
Compound name
6-(oxolan-3-yloxy)pyridin-3-amine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

31
Patents

180.08987 Da
Monoisotopic Mass

0.5
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 181.097146 136.2
[M+Na]+ 203.079088 142.9
[M-H]- 179.082594 141.6
[M+NH4]+ 198.123693 154.5
[M+K]+ 219.053028 142.2
[M+H-H2O]+ 163.087130 128.9
[M+HCOO]- 225.088071 158.8
[M+CH3COO]- 239.103721 179.5
[M+Na-2H]- 201.064536 141.9
[M]+ 180.08932142 134.1
[M]- 180.09041858 134.1
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