CID 58341

N,n-diethyl-2-(3-methyl-1-naphthoxy)ethylamine hydrochloride

Structural Information

Molecular Formula
C17H23NO
SMILES
CCN(CC)CCOC1=CC(=CC2=CC=CC=C21)C
InChI
InChI=1S/C17H23NO/c1-4-18(5-2)10-11-19-17-13-14(3)12-15-8-6-7-9-16(15)17/h6-9,12-13H,4-5,10-11H2,1-3H3
InChIKey
NITILWRQDYCYOL-UHFFFAOYSA-N
Compound name
N,N-diethyl-2-(3-methylnaphthalen-1-yl)oxyethanamine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

257.17798 Da
Monoisotopic Mass

4.3
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 258.185256 162.1
[M+Na]+ 280.167198 168.6
[M-H]- 256.170704 167.5
[M+NH4]+ 275.211803 180.8
[M+K]+ 296.141138 165.8
[M+H-H2O]+ 240.175240 154.6
[M+HCOO]- 302.176181 185.6
[M+CH3COO]- 316.191831 205.4
[M+Na-2H]- 278.152646 167.4
[M]+ 257.17743142 166.3
[M]- 257.17852858 166.3
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.