CID 3064319

2-methyl-1-(1-naphthylmethyl)piperidine

Structural Information

Molecular Formula
C17H21N
SMILES
CC1CCCCN1CC2=CC=CC3=CC=CC=C32
InChI
InChI=1S/C17H21N/c1-14-7-4-5-12-18(14)13-16-10-6-9-15-8-2-3-11-17(15)16/h2-3,6,8-11,14H,4-5,7,12-13H2,1H3
InChIKey
KPBRVOJRBOWAJF-UHFFFAOYSA-N
Compound name
2-methyl-1-(naphthalen-1-ylmethyl)piperidine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

239.1674 Da
Monoisotopic Mass

4.3
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 240.17468 156.9
[M+Na]+ 262.15662 162.3
[M-H]- 238.16012 161.9
[M+NH4]+ 257.20122 173.8
[M+K]+ 278.13056 157.3
[M+H-H2O]+ 222.16466 148.0
[M+HCOO]- 284.16560 174.3
[M+CH3COO]- 298.18125 167.7
[M+Na-2H]- 260.14207 161.9
[M]+ 239.16685 152.5
[M]- 239.16795 152.5
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.