CID 3044111

Benzenebutanamine, delta-phenyl-n,alpha,alpha-trimethyl-, hydrochloride

Structural Information

Molecular Formula
C19H25N
SMILES
CC(C)(CCC(C1=CC=CC=C1)C2=CC=CC=C2)NC
InChI
InChI=1S/C19H25N/c1-19(2,20-3)15-14-18(16-10-6-4-7-11-16)17-12-8-5-9-13-17/h4-13,18,20H,14-15H2,1-3H3
InChIKey
NCKGDRPFGHZICT-UHFFFAOYSA-N
Compound name
N,2-dimethyl-5,5-diphenylpentan-2-amine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

267.1987 Da
Monoisotopic Mass

4.5
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 268.205976 166.6
[M+Na]+ 290.187918 170.4
[M-H]- 266.191424 172.3
[M+NH4]+ 285.232523 182.4
[M+K]+ 306.161858 166.1
[M+H-H2O]+ 250.195960 158.8
[M+HCOO]- 312.196901 187.8
[M+CH3COO]- 326.212551 203.2
[M+Na-2H]- 288.173366 171.8
[M]+ 267.19815142 165.6
[M]- 267.19924858 165.6
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.