CID 75525928

N-[(2-oxocyclohexyl)methyl]formamide

Structural Information

Molecular Formula
C8H13NO2
SMILES
C1CCC(=O)C(C1)CNC=O
InChI
InChI=1S/C8H13NO2/c10-6-9-5-7-3-1-2-4-8(7)11/h6-7H,1-5H2,(H,9,10)
InChIKey
XEKLTJDRKVNHOI-UHFFFAOYSA-N
Compound name
N-[(2-oxocyclohexyl)methyl]formamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

155.09464 Da
Monoisotopic Mass

0.9
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 156.10192 131.9
[M+Na]+ 178.08386 137.2
[M-H]- 154.08736 134.8
[M+NH4]+ 173.12846 152.4
[M+K]+ 194.05780 135.9
[M+H-H2O]+ 138.09190 126.2
[M+HCOO]- 200.09284 154.3
[M+CH3COO]- 214.10849 177.6
[M+Na-2H]- 176.06931 137.3
[M]+ 155.09409 128.2
[M]- 155.09519 128.2
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.