CID 307328

1-ethyl-3-(2-morpholinoethyl)urea

Structural Information

Molecular Formula
C9H19N3O2
SMILES
CCNC(=O)NCCN1CCOCC1
InChI
InChI=1S/C9H19N3O2/c1-2-10-9(13)11-3-4-12-5-7-14-8-6-12/h2-8H2,1H3,(H2,10,11,13)
InChIKey
NJVIMNFRRJVBKF-UHFFFAOYSA-N
Compound name
1-ethyl-3-(2-morpholin-4-ylethyl)urea
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

5
Patents

201.14772 Da
Monoisotopic Mass

-0.6
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 202.15500 148.0
[M+Na]+ 224.13694 150.7
[M-H]- 200.14044 149.5
[M+NH4]+ 219.18154 163.5
[M+K]+ 240.11088 151.0
[M+H-H2O]+ 184.14498 140.1
[M+HCOO]- 246.14592 167.6
[M+CH3COO]- 260.16157 187.6
[M+Na-2H]- 222.12239 153.4
[M]+ 201.14717 144.5
[M]- 201.14827 144.5
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