CID 9439

1-naphthalenemethylamine, n-ethyl-n-(2-fluoroethyl)-

Structural Information

Molecular Formula
C15H18FN
SMILES
CCN(CCF)CC1=CC=CC2=CC=CC=C21
InChI
InChI=1S/C15H18FN/c1-2-17(11-10-16)12-14-8-5-7-13-6-3-4-9-15(13)14/h3-9H,2,10-12H2,1H3
InChIKey
HQCRDFMPWUOYCI-UHFFFAOYSA-N
Compound name
N-ethyl-2-fluoro-N-(naphthalen-1-ylmethyl)ethanamine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

231.14233 Da
Monoisotopic Mass

3.8
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 232.14961 152.5
[M+Na]+ 254.13155 159.0
[M-H]- 230.13505 156.4
[M+NH4]+ 249.17615 171.9
[M+K]+ 270.10549 155.6
[M+H-H2O]+ 214.13959 144.3
[M+HCOO]- 276.14053 175.4
[M+CH3COO]- 290.15618 199.0
[M+Na-2H]- 252.11700 158.9
[M]+ 231.14178 153.0
[M]- 231.14288 153.0
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.