CID 3067790

Cm 40209

Structural Information

Molecular Formula
C13H24N2O2
SMILES
CCCC(=O)NCCCC(=O)NC1CCCC1
InChI
InChI=1S/C13H24N2O2/c1-2-6-12(16)14-10-5-9-13(17)15-11-7-3-4-8-11/h11H,2-10H2,1H3,(H,14,16)(H,15,17)
InChIKey
MSCKBPFYHWSPQR-UHFFFAOYSA-N
Compound name
4-(butanoylamino)-N-cyclopentylbutanamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

240.18378 Da
Monoisotopic Mass

1.2
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 241.19106 161.2
[M+Na]+ 263.17300 163.0
[M-H]- 239.17650 163.2
[M+NH4]+ 258.21760 179.4
[M+K]+ 279.14694 161.4
[M+H-H2O]+ 223.18104 154.1
[M+HCOO]- 285.18198 183.0
[M+CH3COO]- 299.19763 196.7
[M+Na-2H]- 261.15845 161.2
[M]+ 240.18323 158.7
[M]- 240.18433 158.7
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.