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]+ 306.18526 174.6
[M+Na]+ 328.16720 179.2
[M-H]- 304.17070 182.5
[M+NH4]+ 323.21180 190.2
[M+K]+ 344.14114 175.4
[M+H-H2O]+ 288.17524 165.3
[M+HCOO]- 350.17618 196.9
[M+CH3COO]- 364.19183 212.8
[M+Na-2H]- 326.15265 179.6
[M]+ 305.17743 176.3
[M]- 305.17853 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.