CID 138040802

2-cyclopropylmorpholine-4-carbonyl chloride

Structural Information

Molecular Formula
C8H12ClNO2
SMILES
C1CC1C2CN(CCO2)C(=O)Cl
InChI
InChI=1S/C8H12ClNO2/c9-8(11)10-3-4-12-7(5-10)6-1-2-6/h6-7H,1-5H2
InChIKey
QWHHMTXITGPMMZ-UHFFFAOYSA-N
Compound name
2-cyclopropylmorpholine-4-carbonyl chloride
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

189.05565 Da
Monoisotopic Mass

1.2
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 190.062926 140.6
[M+Na]+ 212.044868 148.8
[M-H]- 188.048374 146.6
[M+NH4]+ 207.089473 153.4
[M+K]+ 228.018808 146.8
[M+H-H2O]+ 172.052910 133.7
[M+HCOO]- 234.053851 154.4
[M+CH3COO]- 248.069501 182.3
[M+Na-2H]- 210.030316 145.0
[M]+ 189.05510142 141.7
[M]- 189.05619858 141.7
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.