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]+ 258.18526 162.1
[M+Na]+ 280.16720 168.6
[M-H]- 256.17070 167.5
[M+NH4]+ 275.21180 180.8
[M+K]+ 296.14114 165.8
[M+H-H2O]+ 240.17524 154.6
[M+HCOO]- 302.17618 185.6
[M+CH3COO]- 316.19183 205.4
[M+Na-2H]- 278.15265 167.4
[M]+ 257.17743 166.3
[M]- 257.17853 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.