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]+ 147.057116 126.2
[M+Na]+ 169.039058 136.9
[M-H]- 145.042564 131.3
[M+NH4]+ 164.083663 145.7
[M+K]+ 185.012998 134.5
[M+H-H2O]+ 129.047100 123.0
[M+HCOO]- 191.048041 144.7
[M+CH3COO]- 205.063691 178.7
[M+Na-2H]- 167.024506 132.3
[M]+ 146.04929142 131.4
[M]- 146.05038858 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.