CID 4164570

2-chloro-1,3-dimorpholinopropane dihydrochloride

Structural Information

Molecular Formula
C11H21ClN2O2
SMILES
C1COCCN1CC(CN2CCOCC2)Cl
InChI
InChI=1S/C11H21ClN2O2/c12-11(9-13-1-5-15-6-2-13)10-14-3-7-16-8-4-14/h11H,1-10H2
InChIKey
IIDIFRUQBNODBV-UHFFFAOYSA-N
Compound name
4-(2-chloro-3-morpholin-4-ylpropyl)morpholine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

5
Patents

248.12915 Da
Monoisotopic Mass

0.2
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 249.13643 158.9
[M+Na]+ 271.11837 160.9
[M-H]- 247.12187 161.4
[M+NH4]+ 266.16297 170.4
[M+K]+ 287.09231 160.4
[M+H-H2O]+ 231.12641 149.9
[M+HCOO]- 293.12735 165.6
[M+CH3COO]- 307.14300 189.4
[M+Na-2H]- 269.10382 161.8
[M]+ 248.12860 154.5
[M]- 248.12970 154.5
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