CID 58924

101831-65-6

Structural Information

Molecular Formula
C17H19NO
SMILES
CC1CCCCN1C(=O)C2=CC3=CC=CC=C3C=C2
InChI
InChI=1S/C17H19NO/c1-13-6-4-5-11-18(13)17(19)16-10-9-14-7-2-3-8-15(14)12-16/h2-3,7-10,12-13H,4-6,11H2,1H3
InChIKey
LRRKQSSNALLTQB-UHFFFAOYSA-N
Compound name
(2-methylpiperidin-1-yl)-naphthalen-2-ylmethanone
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

253.14667 Da
Monoisotopic Mass

3.9
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 254.15395 159.4
[M+Na]+ 276.13589 164.8
[M-H]- 252.13939 164.6
[M+NH4]+ 271.18049 175.6
[M+K]+ 292.10983 160.3
[M+H-H2O]+ 236.14393 150.7
[M+HCOO]- 298.14487 176.2
[M+CH3COO]- 312.16052 170.1
[M+Na-2H]- 274.12134 163.3
[M]+ 253.14612 155.1
[M]- 253.14722 155.1
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.