CID 3069317

84509-49-9

Structural Information

Molecular Formula
C15H15NO2
SMILES
C1C2COC(O2)(CN1)C3=CC=CC4=CC=CC=C43
InChI
InChI=1S/C15H15NO2/c1-2-6-13-11(4-1)5-3-7-14(13)15-10-16-8-12(18-15)9-17-15/h1-7,12,16H,8-10H2
InChIKey
FKQMAHYGKQICJL-UHFFFAOYSA-N
Compound name
5-naphthalen-1-yl-6,8-dioxa-3-azabicyclo[3.2.1]octane
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

241.11028 Da
Monoisotopic Mass

1.8
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 242.11756 150.9
[M+Na]+ 264.09950 158.0
[M-H]- 240.10300 156.0
[M+NH4]+ 259.14410 169.6
[M+K]+ 280.07344 155.4
[M+H-H2O]+ 224.10754 143.6
[M+HCOO]- 286.10848 165.2
[M+CH3COO]- 300.12413 162.5
[M+Na-2H]- 262.08495 159.4
[M]+ 241.10973 148.3
[M]- 241.11083 148.3
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.