CID 13017

N-cyclohexylformamide

Structural Information

Molecular Formula
C7H13NO
SMILES
C1CCC(CC1)NC=O
InChI
InChI=1S/C7H13NO/c9-6-8-7-4-2-1-3-5-7/h6-7H,1-5H2,(H,8,9)
InChIKey
SWGXDLRCJNEEGZ-UHFFFAOYSA-N
Compound name
N-cyclohexylformamide
Related CIDs

2D Structure

compound 2d structure
5
Annotation Hits

11
References

5316
Patents

127.09972 Da
Monoisotopic Mass

1.4
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 128.106996 126.1
[M+Na]+ 150.088938 130.6
[M-H]- 126.092444 128.9
[M+NH4]+ 145.133543 147.6
[M+K]+ 166.062878 129.8
[M+H-H2O]+ 110.096980 120.5
[M+HCOO]- 172.097921 148.4
[M+CH3COO]- 186.113571 172.3
[M+Na-2H]- 148.074386 132.7
[M]+ 127.09917142 120.9
[M]- 127.10026858 120.9
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

Literature stripe

literature stripe

Patent stripe

patents stripe