CID 19616379

1197228-24-2

Structural Information

Molecular Formula
C6H11N3O
SMILES
CN1C=CN=C1C(CN)O
InChI
InChI=1S/C6H11N3O/c1-9-3-2-8-6(9)5(10)4-7/h2-3,5,10H,4,7H2,1H3
InChIKey
AJOFBNLXIBLIPM-UHFFFAOYSA-N
Compound name
2-amino-1-(1-methylimidazol-2-yl)ethanol
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

15
Patents

141.09021 Da
Monoisotopic Mass

-1.7
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 142.09749 129.2
[M+Na]+ 164.07943 137.2
[M-H]- 140.08293 128.8
[M+NH4]+ 159.12403 148.8
[M+K]+ 180.05337 135.7
[M+H-H2O]+ 124.08747 122.4
[M+HCOO]- 186.08841 151.0
[M+CH3COO]- 200.10406 173.3
[M+Na-2H]- 162.06488 133.5
[M]+ 141.08966 127.3
[M]- 141.09076 127.3
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

patents stripe