CID 13501614

N-cyclohexyl-2-iodoacetamide

Structural Information

Molecular Formula
C8H14INO
SMILES
C1CCC(CC1)NC(=O)CI
InChI
InChI=1S/C8H14INO/c9-6-8(11)10-7-4-2-1-3-5-7/h7H,1-6H2,(H,10,11)
InChIKey
AOIWGBPSQWOEJO-UHFFFAOYSA-N
Compound name
N-cyclohexyl-2-iodoacetamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

267.01202 Da
Monoisotopic Mass

2.0
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 268.01930 146.6
[M+Na]+ 290.00124 143.3
[M-H]- 266.00474 142.1
[M+NH4]+ 285.04584 161.6
[M+K]+ 305.97518 148.1
[M+H-H2O]+ 250.00928 137.0
[M+HCOO]- 312.01022 162.2
[M+CH3COO]- 326.02587 187.1
[M+Na-2H]- 287.98669 138.5
[M]+ 267.01147 138.8
[M]- 267.01257 138.8
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.