CID 22041944

2-(chloromethyl)oxetane

Structural Information

Molecular Formula
C4H7ClO
SMILES
C1COC1CCl
InChI
InChI=1S/C4H7ClO/c5-3-4-1-2-6-4/h4H,1-3H2
InChIKey
MTJUELTVQKBEPR-UHFFFAOYSA-N
Compound name
2-(chloromethyl)oxetane
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

1082
Patents

106.01854 Da
Monoisotopic Mass

0.9
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 107.02582 108.2
[M+Na]+ 129.00776 115.7
[M-H]- 105.01126 112.4
[M+NH4]+ 124.05236 124.5
[M+K]+ 144.98170 118.2
[M+H-H2O]+ 89.015800 100.2
[M+HCOO]- 151.01674 126.2
[M+CH3COO]- 165.03239 168.8
[M+Na-2H]- 126.99321 117.6
[M]+ 106.01799 118.4
[M]- 106.01909 118.4
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.