CID 155822538

2-methylazetidine-1-carbonyl chloride

Structural Information

Molecular Formula
C5H8ClNO
SMILES
CC1CCN1C(=O)Cl
InChI
InChI=1S/C5H8ClNO/c1-4-2-3-7(4)5(6)8/h4H,2-3H2,1H3
InChIKey
BDZSOZGNXGZREG-UHFFFAOYSA-N
Compound name
2-methylazetidine-1-carbonyl chloride
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

133.02943 Da
Monoisotopic Mass

1.3
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 134.03671 119.4
[M+Na]+ 156.01865 127.5
[M-H]- 132.02215 121.7
[M+NH4]+ 151.06325 134.8
[M+K]+ 171.99259 128.5
[M+H-H2O]+ 116.02669 110.2
[M+HCOO]- 178.02763 135.8
[M+CH3COO]- 192.04328 174.7
[M+Na-2H]- 154.00410 124.9
[M]+ 133.02888 128.7
[M]- 133.02998 128.7
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.