CID 55288148

1-(2-hydroxyethyl)-1,3-diazinan-2-one

Structural Information

Molecular Formula
C6H12N2O2
SMILES
C1CNC(=O)N(C1)CCO
InChI
InChI=1S/C6H12N2O2/c9-5-4-8-3-1-2-7-6(8)10/h9H,1-5H2,(H,7,10)
InChIKey
SNUUBCVNJIAAML-UHFFFAOYSA-N
Compound name
1-(2-hydroxyethyl)-1,3-diazinan-2-one
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

92
Patents

144.08987 Da
Monoisotopic Mass

-1.0
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 145.09715 131.6
[M+Na]+ 167.07909 137.5
[M-H]- 143.08259 129.1
[M+NH4]+ 162.12369 148.8
[M+K]+ 183.05303 135.4
[M+H-H2O]+ 127.08713 125.1
[M+HCOO]- 189.08807 147.8
[M+CH3COO]- 203.10372 167.8
[M+Na-2H]- 165.06454 136.6
[M]+ 144.08932 126.0
[M]- 144.09042 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