CID 83694228

5-hydroxy-1-methyl-1,3-diazinan-2-one

Structural Information

Molecular Formula
C5H10N2O2
SMILES
CN1CC(CNC1=O)O
InChI
InChI=1S/C5H10N2O2/c1-7-3-4(8)2-6-5(7)9/h4,8H,2-3H2,1H3,(H,6,9)
InChIKey
FUIVIYZQYPWELC-UHFFFAOYSA-N
Compound name
5-hydroxy-1-methyl-1,3-diazinan-2-one
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

18
Patents

130.07423 Da
Monoisotopic Mass

-1.3
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 131.08151 127.1
[M+Na]+ 153.06345 134.4
[M-H]- 129.06695 125.2
[M+NH4]+ 148.10805 145.2
[M+K]+ 169.03739 132.6
[M+H-H2O]+ 113.07149 121.1
[M+HCOO]- 175.07243 143.6
[M+CH3COO]- 189.08808 166.0
[M+Na-2H]- 151.04890 131.9
[M]+ 130.07368 121.5
[M]- 130.07478 121.5
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