CID 15287401

4-(2-chloroethyl)morpholin-3-one

Structural Information

Molecular Formula
C6H10ClNO2
SMILES
C1COCC(=O)N1CCCl
InChI
InChI=1S/C6H10ClNO2/c7-1-2-8-3-4-10-5-6(8)9/h1-5H2
InChIKey
RZXPWTTVDMZISW-UHFFFAOYSA-N
Compound name
4-(2-chloroethyl)morpholin-3-one
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

13
Patents

163.04001 Da
Monoisotopic Mass

0.0
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 164.04729 130.4
[M+Na]+ 186.02923 142.6
[M+NH4]+ 181.07383 138.8
[M+K]+ 202.00317 136.7
[M-H]- 162.03273 132.6
[M+Na-2H]- 184.01468 135.2
[M]+ 163.03946 132.9
[M]- 163.04056 132.9
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

patents stripe