CID 45380

N,n-dimethyl-2-(1-naphthyl(phenyl)methoxy)ethylamine hydrochloride

Structural Information

Molecular Formula
C21H23NO
SMILES
CN(C)CCOC(C1=CC=CC=C1)C2=CC=CC3=CC=CC=C32
InChI
InChI=1S/C21H23NO/c1-22(2)15-16-23-21(18-10-4-3-5-11-18)20-14-8-12-17-9-6-7-13-19(17)20/h3-14,21H,15-16H2,1-2H3
InChIKey
UUANXCCUZYBHAN-UHFFFAOYSA-N
Compound name
N,N-dimethyl-2-[naphthalen-1-yl(phenyl)methoxy]ethanamine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

305.17798 Da
Monoisotopic Mass

4.8
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 306.185256 174.6
[M+Na]+ 328.167198 179.2
[M-H]- 304.170704 182.5
[M+NH4]+ 323.211803 190.2
[M+K]+ 344.141138 175.4
[M+H-H2O]+ 288.175240 165.3
[M+HCOO]- 350.176181 196.9
[M+CH3COO]- 364.191831 212.8
[M+Na-2H]- 326.152646 179.6
[M]+ 305.17743142 176.3
[M]- 305.17852858 176.3
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.