CID 13787913

[3-(4-tert-butylphenyl)-2-methylpropyl](methyl)amine

Structural Information

Molecular Formula
C15H25N
SMILES
CC(CC1=CC=C(C=C1)C(C)(C)C)CNC
InChI
InChI=1S/C15H25N/c1-12(11-16-5)10-13-6-8-14(9-7-13)15(2,3)4/h6-9,12,16H,10-11H2,1-5H3
InChIKey
PWSCRZWBXSRVNG-UHFFFAOYSA-N
Compound name
3-(4-tert-butylphenyl)-N,2-dimethylpropan-1-amine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

10
Patents

219.1987 Da
Monoisotopic Mass

4.2
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 220.20598 156.0
[M+Na]+ 242.18792 167.3
[M+NH4]+ 237.23252 164.5
[M+K]+ 258.16186 160.4
[M-H]- 218.19142 158.8
[M+Na-2H]- 240.17337 162.3
[M]+ 219.19815 158.5
[M]- 219.19925 158.5
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

patents stripe