CID 3044115

Phenethylamine, beta-phenyl-n,n,alpha,alpha-tetramethyl-, hydrochloride

Structural Information

Molecular Formula
C18H23N
SMILES
CC(C)(C(C1=CC=CC=C1)C2=CC=CC=C2)N(C)C
InChI
InChI=1S/C18H23N/c1-18(2,19(3)4)17(15-11-7-5-8-12-15)16-13-9-6-10-14-16/h5-14,17H,1-4H3
InChIKey
XMPOTJAMAJBZHI-UHFFFAOYSA-N
Compound name
N,N,2-trimethyl-1,1-diphenylpropan-2-amine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

253.18304 Da
Monoisotopic Mass

4.3
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 254.190316 161.6
[M+Na]+ 276.172258 166.0
[M-H]- 252.175764 169.0
[M+NH4]+ 271.216863 178.6
[M+K]+ 292.146198 163.4
[M+H-H2O]+ 236.180300 153.8
[M+HCOO]- 298.181241 183.6
[M+CH3COO]- 312.196891 203.6
[M+Na-2H]- 274.157706 166.7
[M]+ 253.18249142 161.6
[M]- 253.18358858 161.6
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.