CID 24472

2-chlorooxirane

Structural Information

Molecular Formula
C2H3ClO
SMILES
C1C(O1)Cl
InChI
InChI=1S/C2H3ClO/c3-2-1-4-2/h2H,1H2
InChIKey
WBNCHVFLFSFIGK-UHFFFAOYSA-N
Compound name
2-chlorooxirane
Related CIDs

2D Structure

compound 2d structure
2
Annotation Hits

53
References

311
Patents

77.98724 Da
Monoisotopic Mass

0.6
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 78.994516 107.3
[M+Na]+ 100.97646 118.5
[M-H]- 76.979964 113.0
[M+NH4]+ 96.021063 126.1
[M+K]+ 116.95040 118.0
[M+H-H2O]+ 60.984500 102.9
[M+HCOO]- 122.98544 127.4
[M+CH3COO]- 137.00109 163.7
[M+Na-2H]- 98.961906 117.7
[M]+ 77.986691 111.8
[M]- 77.987789 111.8
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