CID 213718

Tai 241

Structural Information

Molecular Formula
C16H20ClNO
SMILES
C1CCC(CC1)C2=C(C=C(C=C2)C3(CC3)C(=O)N)Cl
InChI
InChI=1S/C16H20ClNO/c17-14-10-12(16(8-9-16)15(18)19)6-7-13(14)11-4-2-1-3-5-11/h6-7,10-11H,1-5,8-9H2,(H2,18,19)
InChIKey
YFZNRBBOKWZYEL-UHFFFAOYSA-N
Compound name
1-(3-chloro-4-cyclohexylphenyl)cyclopropane-1-carboxamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

277.12335 Da
Monoisotopic Mass

4.2
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 278.13063 158.7
[M+Na]+ 300.11257 165.7
[M-H]- 276.11607 167.6
[M+NH4]+ 295.15717 171.9
[M+K]+ 316.08651 161.0
[M+H-H2O]+ 260.12061 152.7
[M+HCOO]- 322.12155 174.0
[M+CH3COO]- 336.13720 201.9
[M+Na-2H]- 298.09802 160.9
[M]+ 277.12280 157.4
[M]- 277.12390 157.4
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.