CID 86812210

N-(azepan-4-yl)-n-cyclobutylacetamide

Structural Information

Molecular Formula
C12H22N2O
SMILES
CC(=O)N(C1CCC1)C2CCCNCC2
InChI
InChI=1S/C12H22N2O/c1-10(15)14(11-4-2-5-11)12-6-3-8-13-9-7-12/h11-13H,2-9H2,1H3
InChIKey
WGOYOQVDTMEVLJ-UHFFFAOYSA-N
Compound name
N-(azepan-4-yl)-N-cyclobutylacetamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

210.17322 Da
Monoisotopic Mass

1.1
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 211.18050 149.4
[M+Na]+ 233.16244 148.4
[M-H]- 209.16594 153.8
[M+NH4]+ 228.20704 158.4
[M+K]+ 249.13638 153.5
[M+H-H2O]+ 193.17048 137.4
[M+HCOO]- 255.17142 164.4
[M+CH3COO]- 269.18707 193.7
[M+Na-2H]- 231.14789 150.1
[M]+ 210.17267 147.8
[M]- 210.17377 147.8
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.