CID 26910

Brn 2129655

Structural Information

Molecular Formula
C15H23ClN2O
SMILES
CC(C)C(CCN(C)C)(C1=CC=C(C=C1)Cl)C(=O)N
InChI
InChI=1S/C15H23ClN2O/c1-11(2)15(14(17)19,9-10-18(3)4)12-5-7-13(16)8-6-12/h5-8,11H,9-10H2,1-4H3,(H2,17,19)
InChIKey
DQANHXZCJZDGBT-UHFFFAOYSA-N
Compound name
2-(4-chlorophenyl)-2-[2-(dimethylamino)ethyl]-3-methylbutanamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

282.1499 Da
Monoisotopic Mass

2.9
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 283.15718 168.5
[M+Na]+ 305.13912 173.8
[M-H]- 281.14262 172.6
[M+NH4]+ 300.18372 185.2
[M+K]+ 321.11306 170.7
[M+H-H2O]+ 265.14716 162.7
[M+HCOO]- 327.14810 185.4
[M+CH3COO]- 341.16375 210.1
[M+Na-2H]- 303.12457 169.4
[M]+ 282.14935 170.9
[M]- 282.15045 170.9
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.