CID 90024

23194-13-0

Structural Information

Molecular Formula
C12H26N4O4
SMILES
C(CCCNC(=O)NCCO)CCNC(=O)NCCO
InChI
InChI=1S/C12H26N4O4/c17-9-7-15-11(19)13-5-3-1-2-4-6-14-12(20)16-8-10-18/h17-18H,1-10H2,(H2,13,15,19)(H2,14,16,20)
InChIKey
IEPBGXYJCMRGCN-UHFFFAOYSA-N
Compound name
1-(2-hydroxyethyl)-3-[6-(2-hydroxyethylcarbamoylamino)hexyl]urea
Related CIDs

2D Structure

compound 2d structure
2
Annotation Hits

0
References

14
Patents

290.1954 Da
Monoisotopic Mass

-1.4
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 291.20268 170.3
[M+Na]+ 313.18462 171.8
[M+NH4]+ 308.22922 172.6
[M+K]+ 329.15856 169.4
[M-H]- 289.18812 167.3
[M+Na-2H]- 311.17007 168.5
[M]+ 290.19485 168.5
[M]- 290.19595 168.5
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