CID 3060762

78265-90-4

Structural Information

Molecular Formula
C15H23ClN2O
SMILES
CCCCC(C(=O)NC1=C(C=CC=C1Cl)C)NCC
InChI
InChI=1S/C15H23ClN2O/c1-4-6-10-13(17-5-2)15(19)18-14-11(3)8-7-9-12(14)16/h7-9,13,17H,4-6,10H2,1-3H3,(H,18,19)
InChIKey
RIJZZXCVNSTOOF-UHFFFAOYSA-N
Compound name
N-(2-chloro-6-methylphenyl)-2-(ethylamino)hexanamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

282.1499 Da
Monoisotopic Mass

3.0
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 283.15718 168.3
[M+Na]+ 305.13912 178.9
[M+NH4]+ 300.18372 175.6
[M+K]+ 321.11306 171.7
[M-H]- 281.14262 170.9
[M+Na-2H]- 303.12457 173.1
[M]+ 282.14935 170.6
[M]- 282.15045 170.6
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.