CID 58889

Brn 0220542

Structural Information

Molecular Formula
C18H23NO
SMILES
CCC1CCN(CC1)CC2=C(C=CC3=CC=CC=C32)O
InChI
InChI=1S/C18H23NO/c1-2-14-9-11-19(12-10-14)13-17-16-6-4-3-5-15(16)7-8-18(17)20/h3-8,14,20H,2,9-13H2,1H3
InChIKey
GGSLOBUNSAAFTP-UHFFFAOYSA-N
Compound name
1-[(4-ethylpiperidin-1-yl)methyl]naphthalen-2-ol
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

269.17798 Da
Monoisotopic Mass

4.5
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 270.185256 165.3
[M+Na]+ 292.167198 170.7
[M-H]- 268.170704 169.1
[M+NH4]+ 287.211803 180.6
[M+K]+ 308.141138 165.2
[M+H-H2O]+ 252.175240 156.6
[M+HCOO]- 314.176181 181.1
[M+CH3COO]- 328.191831 175.2
[M+Na-2H]- 290.152646 168.6
[M]+ 269.17743142 161.3
[M]- 269.17852858 161.3
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.