CID 214386

33132-71-7

Structural Information

Molecular Formula
C14H22ClN
SMILES
CCC(C)C(CN(C)C)C1=CC=C(C=C1)Cl
InChI
InChI=1S/C14H22ClN/c1-5-11(2)14(10-16(3)4)12-6-8-13(15)9-7-12/h6-9,11,14H,5,10H2,1-4H3
InChIKey
QJDYHTSUWFVOBF-UHFFFAOYSA-N
Compound name
2-(4-chlorophenyl)-N,N,3-trimethylpentan-1-amine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

239.14407 Da
Monoisotopic Mass

4.5
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 240.15135 157.0
[M+Na]+ 262.13329 169.4
[M+NH4]+ 257.17789 166.2
[M+K]+ 278.10723 162.0
[M-H]- 238.13679 160.5
[M+Na-2H]- 260.11874 163.6
[M]+ 239.14352 160.1
[M]- 239.14462 160.1
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.