CID 90067

4-chloromorpholine

Structural Information

Molecular Formula
C4H8ClNO
SMILES
C1COCCN1Cl
InChI
InChI=1S/C4H8ClNO/c5-6-1-3-7-4-2-6/h1-4H2
InChIKey
ILNGCUVXLQVDTC-UHFFFAOYSA-N
Compound name
4-chloromorpholine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

589
Patents

121.02944 Da
Monoisotopic Mass

0.2
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 122.03672 120.3
[M+Na]+ 144.01866 127.3
[M-H]- 120.02216 122.4
[M+NH4]+ 139.06326 140.6
[M+K]+ 159.99260 126.9
[M+H-H2O]+ 104.02670 115.0
[M+HCOO]- 166.02764 135.4
[M+CH3COO]- 180.04329 165.8
[M+Na-2H]- 142.00411 128.6
[M]+ 121.02889 118.3
[M]- 121.02999 118.3
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

No patent data available for this compound.