CID 21900574

3-(chloromethyl)oxetane

Structural Information

Molecular Formula
C4H7ClO
SMILES
C1C(CO1)CCl
InChI
InChI=1S/C4H7ClO/c5-1-4-2-6-3-4/h4H,1-3H2
InChIKey
LIPUPFCIDWQWAP-UHFFFAOYSA-N
Compound name
3-(chloromethyl)oxetane
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

135
Patents

106.01854 Da
Monoisotopic Mass

0.7
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 107.02582 110.0
[M+Na]+ 129.00776 118.3
[M+NH4]+ 124.05236 116.0
[M+K]+ 144.98170 114.6
[M-H]- 105.01126 110.4
[M+Na-2H]- 126.99321 114.2
[M]+ 106.01799 110.4
[M]- 106.01909 110.4
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

Literature stripe

literature stripe

Patent stripe

patents stripe