CID 28089

Butyramide, n-(4-piperidino-2-butynyl)-, oxalate (1:1)

Structural Information

Molecular Formula
C13H22N2O
SMILES
CCCC(=O)NCC#CCN1CCCCC1
InChI
InChI=1S/C13H22N2O/c1-2-8-13(16)14-9-4-7-12-15-10-5-3-6-11-15/h2-3,5-6,8-12H2,1H3,(H,14,16)
InChIKey
MUDKQIQDIDQMTA-UHFFFAOYSA-N
Compound name
N-(4-piperidin-1-ylbut-2-ynyl)butanamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

222.17322 Da
Monoisotopic Mass

1.3
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 223.18050 157.8
[M+Na]+ 245.16244 166.2
[M+NH4]+ 240.20704 161.2
[M+K]+ 261.13638 156.7
[M-H]- 221.16594 150.7
[M+Na-2H]- 243.14789 158.1
[M]+ 222.17267 155.8
[M]- 222.17377 155.8
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.