CID 40511

Piperidine, 1-((2-methoxy-1-anthracenyl)methyl)-, hydrochloride

Structural Information

Molecular Formula
C21H23NO
SMILES
COC1=C(C2=CC3=CC=CC=C3C=C2C=C1)CN4CCCCC4
InChI
InChI=1S/C21H23NO/c1-23-21-10-9-18-13-16-7-3-4-8-17(16)14-19(18)20(21)15-22-11-5-2-6-12-22/h3-4,7-10,13-14H,2,5-6,11-12,15H2,1H3
InChIKey
WMYLZPXLLKIHBV-UHFFFAOYSA-N
Compound name
1-[(2-methoxyanthracen-1-yl)methyl]piperidine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

305.17798 Da
Monoisotopic Mass

4.8
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 306.185256 173.1
[M+Na]+ 328.167198 179.9
[M-H]- 304.170704 179.2
[M+NH4]+ 323.211803 188.3
[M+K]+ 344.141138 173.6
[M+H-H2O]+ 288.175240 162.9
[M+HCOO]- 350.176181 190.3
[M+CH3COO]- 364.191831 183.3
[M+Na-2H]- 326.152646 179.0
[M]+ 305.17743142 171.7
[M]- 305.17852858 171.7
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.