CID 4687870

N-[(2-methoxynaphthalen-1-yl)methyl]cyclopentanamine

Structural Information

Molecular Formula
C17H21NO
SMILES
COC1=C(C2=CC=CC=C2C=C1)CNC3CCCC3
InChI
InChI=1S/C17H21NO/c1-19-17-11-10-13-6-2-5-9-15(13)16(17)12-18-14-7-3-4-8-14/h2,5-6,9-11,14,18H,3-4,7-8,12H2,1H3
InChIKey
CCCYAJFXIRKIRB-UHFFFAOYSA-N
Compound name
N-[(2-methoxynaphthalen-1-yl)methyl]cyclopentanamine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

255.16231 Da
Monoisotopic Mass

3.8
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 256.16959 160.8
[M+Na]+ 278.15153 173.3
[M+NH4]+ 273.19613 170.9
[M+K]+ 294.12547 166.3
[M-H]- 254.15503 166.6
[M+Na-2H]- 276.13698 168.3
[M]+ 255.16176 164.3
[M]- 255.16286 164.3
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.