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]+ 134.036706 119.4
[M+Na]+ 156.018648 127.5
[M-H]- 132.022154 121.7
[M+NH4]+ 151.063253 134.8
[M+K]+ 171.992588 128.5
[M+H-H2O]+ 116.026690 110.2
[M+HCOO]- 178.027631 135.8
[M+CH3COO]- 192.043281 174.7
[M+Na-2H]- 154.004096 124.9
[M]+ 133.02888142 128.7
[M]- 133.02997858 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.