CID 3067793

Cm 40316

Structural Information

Molecular Formula
C15H22N2O2
SMILES
CCCC(=O)NCCCC(=O)NCC1=CC=CC=C1
InChI
InChI=1S/C15H22N2O2/c1-2-7-14(18)16-11-6-10-15(19)17-12-13-8-4-3-5-9-13/h3-5,8-9H,2,6-7,10-12H2,1H3,(H,16,18)(H,17,19)
InChIKey
UHDIGISIRPCAGX-UHFFFAOYSA-N
Compound name
N-benzyl-4-(butanoylamino)butanamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

262.16812 Da
Monoisotopic Mass

1.5
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 263.17540 165.0
[M+Na]+ 285.15734 173.6
[M+NH4]+ 280.20194 171.2
[M+K]+ 301.13128 167.4
[M-H]- 261.16084 166.7
[M+Na-2H]- 283.14279 169.6
[M]+ 262.16757 166.3
[M]- 262.16867 166.3
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.