CID 11062580

2-chloro-1-(1-chlorocyclopropyl)ethanone

Structural Information

Molecular Formula
C5H6Cl2O
SMILES
C1CC1(C(=O)CCl)Cl
InChI
InChI=1S/C5H6Cl2O/c6-3-4(8)5(7)1-2-5/h1-3H2
InChIKey
VHHGLRZRRBYTNE-UHFFFAOYSA-N
Compound name
2-chloro-1-(1-chlorocyclopropyl)ethanone
Related CIDs

2D Structure

compound 2d structure
2
Annotation Hits

0
References

129
Patents

151.97957 Da
Monoisotopic Mass

1.5
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 152.98685 124.6
[M+Na]+ 174.96879 138.4
[M+NH4]+ 170.01339 135.6
[M+K]+ 190.94273 131.9
[M-H]- 150.97229 132.2
[M+Na-2H]- 172.95424 134.5
[M]+ 151.97902 130.4
[M]- 151.98012 130.4
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

patents stripe