CID 13296069

92915-18-9

Structural Information

Molecular Formula
C6H10N6O2
SMILES
CCOC1=NC(=NC(=N1)NC(=O)N)N
InChI
InChI=1S/C6H10N6O2/c1-2-14-6-10-3(7)9-5(12-6)11-4(8)13/h2H2,1H3,(H5,7,8,9,10,11,12,13)
InChIKey
HXTBBPRUQJQDRL-UHFFFAOYSA-N
Compound name
(4-amino-6-ethoxy-1,3,5-triazin-2-yl)urea
Related CIDs

2D Structure

compound 2d structure
2
Annotation Hits

0
References

0
Patents

198.08652 Da
Monoisotopic Mass

-0.8
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 199.09380 141.4
[M+Na]+ 221.07574 149.5
[M-H]- 197.07924 141.0
[M+NH4]+ 216.12034 155.5
[M+K]+ 237.04968 147.8
[M+H-H2O]+ 181.08378 132.8
[M+HCOO]- 243.08472 164.5
[M+CH3COO]- 257.10037 190.4
[M+Na-2H]- 219.06119 147.8
[M]+ 198.08597 139.7
[M]- 198.08707 139.7
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

Literature stripe

literature stripe

Patent stripe

No patent data available for this compound.