CID 58684057

2413875-15-5

Structural Information

Molecular Formula
C6H9N3O
SMILES
C1=CN=C(N=C1)OCCN
InChI
InChI=1S/C6H9N3O/c7-2-5-10-6-8-3-1-4-9-6/h1,3-4H,2,5,7H2
InChIKey
OUOPDDNPXZHMDY-UHFFFAOYSA-N
Compound name
2-pyrimidin-2-yloxyethanamine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

13
Patents

139.07455 Da
Monoisotopic Mass

-0.6
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 140.08183 126.5
[M+Na]+ 162.06377 134.3
[M-H]- 138.06727 126.9
[M+NH4]+ 157.10837 144.8
[M+K]+ 178.03771 132.9
[M+H-H2O]+ 122.07181 119.0
[M+HCOO]- 184.07275 150.1
[M+CH3COO]- 198.08840 173.8
[M+Na-2H]- 160.04922 135.8
[M]+ 139.07400 126.0
[M]- 139.07510 126.0
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