CID 3066338

Beta-dimethylaminoethyl alpha-(beta-tetralyl)benzyl ether hydrochloride

Structural Information

Molecular Formula
C21H27NO
SMILES
CN(C)CCOC(C1=CC=CC=C1)C2=CC3=C(CCCC3)C=C2
InChI
InChI=1S/C21H27NO/c1-22(2)14-15-23-21(18-9-4-3-5-10-18)20-13-12-17-8-6-7-11-19(17)16-20/h3-5,9-10,12-13,16,21H,6-8,11,14-15H2,1-2H3
InChIKey
AUYAAADZLKIENT-UHFFFAOYSA-N
Compound name
N,N-dimethyl-2-[phenyl(5,6,7,8-tetrahydronaphthalen-2-yl)methoxy]ethanamine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

309.20926 Da
Monoisotopic Mass

4.7
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 310.21654 177.1
[M+Na]+ 332.19848 190.2
[M+NH4]+ 327.24308 186.8
[M+K]+ 348.17242 181.0
[M-H]- 308.20198 183.7
[M+Na-2H]- 330.18393 185.5
[M]+ 309.20871 180.9
[M]- 309.20981 180.9
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.