CID 99719150

Cyclopropyl(2,6-dichlorophenyl)methanone

Structural Information

Molecular Formula
C10H8Cl2O
SMILES
C1CC1C(=O)C2=C(C=CC=C2Cl)Cl
InChI
InChI=1S/C10H8Cl2O/c11-7-2-1-3-8(12)9(7)10(13)6-4-5-6/h1-3,6H,4-5H2
InChIKey
DWAMSGJRCLTENE-UHFFFAOYSA-N
Compound name
cyclopropyl-(2,6-dichlorophenyl)methanone
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

213.99522 Da
Monoisotopic Mass

3.3
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 215.00250 135.4
[M+Na]+ 236.98444 146.5
[M-H]- 212.98794 142.3
[M+NH4]+ 232.02904 150.7
[M+K]+ 252.95838 141.1
[M+H-H2O]+ 196.99248 130.6
[M+HCOO]- 258.99342 150.1
[M+CH3COO]- 273.00907 188.8
[M+Na-2H]- 234.96989 140.0
[M]+ 213.99467 140.4
[M]- 213.99577 140.4
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.