CID 695479

103660-34-0

Structural Information

Molecular Formula
C18H17NO
SMILES
C1CN\2CCC1C(=O)/C2=C/C3=CC=CC4=CC=CC=C43
InChI
InChI=1S/C18H17NO/c20-18-14-8-10-19(11-9-14)17(18)12-15-6-3-5-13-4-1-2-7-16(13)15/h1-7,12,14H,8-11H2/b17-12-
InChIKey
AJHSKARRJJFMLZ-ATVHPVEESA-N
Compound name
(2Z)-2-(naphthalen-1-ylmethylidene)-1-azabicyclo[2.2.2]octan-3-one
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

263.131 Da
Monoisotopic Mass

3.9
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 264.13828 157.9
[M+Na]+ 286.12022 172.2
[M+NH4]+ 281.16482 169.6
[M+K]+ 302.09416 162.2
[M-H]- 262.12372 159.7
[M+Na-2H]- 284.10567 159.3
[M]+ 263.13045 160.6
[M]- 263.13155 160.6
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.