CID 3086338

Gea 693

Structural Information

Molecular Formula
C16H26N2O
SMILES
CCCNC(C)C(=O)NC(C)(C)C1=CC=C(C=C1)C
InChI
InChI=1S/C16H26N2O/c1-6-11-17-13(3)15(19)18-16(4,5)14-9-7-12(2)8-10-14/h7-10,13,17H,6,11H2,1-5H3,(H,18,19)
InChIKey
FZHNPASYORMJPV-UHFFFAOYSA-N
Compound name
N-[2-(4-methylphenyl)propan-2-yl]-2-(propylamino)propanamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

262.2045 Da
Monoisotopic Mass

2.9
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 263.21178 166.8
[M+Na]+ 285.19372 175.7
[M+NH4]+ 280.23832 173.5
[M+K]+ 301.16766 170.2
[M-H]- 261.19722 168.6
[M+Na-2H]- 283.17917 171.4
[M]+ 262.20395 168.4
[M]- 262.20505 168.4
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.