CID 107003707

1700262-60-7

Structural Information

Molecular Formula
C7H11ClO
SMILES
CC1(CC1C(=O)CCl)C
InChI
InChI=1S/C7H11ClO/c1-7(2)3-5(7)6(9)4-8/h5H,3-4H2,1-2H3
InChIKey
ASTVNHOUNYKVAF-UHFFFAOYSA-N
Compound name
2-chloro-1-(2,2-dimethylcyclopropyl)ethanone
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

146.04984 Da
Monoisotopic Mass

1.9
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 147.05712 126.2
[M+Na]+ 169.03906 136.9
[M-H]- 145.04256 131.3
[M+NH4]+ 164.08366 145.7
[M+K]+ 185.01300 134.5
[M+H-H2O]+ 129.04710 123.0
[M+HCOO]- 191.04804 144.7
[M+CH3COO]- 205.06369 178.7
[M+Na-2H]- 167.02451 132.3
[M]+ 146.04929 131.4
[M]- 146.05039 131.4
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.