CID 211608

N-(alpha-cyclobutylbenzyl)-2-(propylamino)propionamide hydrochloride

Structural Information

Molecular Formula
C17H26N2O
SMILES
CCCNC(C)C(=O)NC(C1CCC1)C2=CC=CC=C2
InChI
InChI=1S/C17H26N2O/c1-3-12-18-13(2)17(20)19-16(15-10-7-11-15)14-8-5-4-6-9-14/h4-6,8-9,13,15-16,18H,3,7,10-12H2,1-2H3,(H,19,20)
InChIKey
PYNJXVPFPALPHQ-UHFFFAOYSA-N
Compound name
N-[cyclobutyl(phenyl)methyl]-2-(propylamino)propanamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

274.2045 Da
Monoisotopic Mass

3.3
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 275.21178 174.0
[M+Na]+ 297.19372 177.8
[M+NH4]+ 292.23832 177.1
[M+K]+ 313.16766 173.5
[M-H]- 273.19722 174.8
[M+Na-2H]- 295.17917 176.4
[M]+ 274.20395 173.3
[M]- 274.20505 173.3
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.