CID 17897827

1-(3-chlorophenyl)cyclopropane-1-carboxamide

Structural Information

Molecular Formula
C10H10ClNO
SMILES
C1CC1(C2=CC(=CC=C2)Cl)C(=O)N
InChI
InChI=1S/C10H10ClNO/c11-8-3-1-2-7(6-8)10(4-5-10)9(12)13/h1-3,6H,4-5H2,(H2,12,13)
InChIKey
RWKWCWCDZUWUGE-UHFFFAOYSA-N
Compound name
1-(3-chlorophenyl)cyclopropane-1-carboxamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

22
Patents

195.04509 Da
Monoisotopic Mass

1.7
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 196.05237 135.8
[M+Na]+ 218.03431 146.0
[M-H]- 194.03781 143.1
[M+NH4]+ 213.07891 152.6
[M+K]+ 234.00825 142.0
[M+H-H2O]+ 178.04235 131.2
[M+HCOO]- 240.04329 155.7
[M+CH3COO]- 254.05894 186.6
[M+Na-2H]- 216.01976 142.1
[M]+ 195.04454 138.4
[M]- 195.04564 138.4
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