CID 96091

2212-45-5

Structural Information

Molecular Formula
C23H20O2
SMILES
COC1=C(C2=CC=CC=C2C=C1)CC3=C(C=CC4=CC=CC=C43)OC
InChI
InChI=1S/C23H20O2/c1-24-22-13-11-16-7-3-5-9-18(16)20(22)15-21-19-10-6-4-8-17(19)12-14-23(21)25-2/h3-14H,15H2,1-2H3
InChIKey
WOAKPXSTZYSSEU-UHFFFAOYSA-N
Compound name
2-methoxy-1-[(2-methoxynaphthalen-1-yl)methyl]naphthalene
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

11
Patents

328.14633 Da
Monoisotopic Mass

6.3
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 329.15361 179.1
[M+Na]+ 351.13555 188.7
[M-H]- 327.13905 187.9
[M+NH4]+ 346.18015 195.1
[M+K]+ 367.10949 182.7
[M+H-H2O]+ 311.14359 169.4
[M+HCOO]- 373.14453 201.2
[M+CH3COO]- 387.16018 190.9
[M+Na-2H]- 349.12100 186.1
[M]+ 328.14578 183.9
[M]- 328.14688 183.9
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

patents stripe