CID 10018517

159333-30-9

Structural Information

Molecular Formula
C22H18O2
SMILES
C1=CC=C2C=C(C=CC2=C1)[C@H]([C@@H](C3=CC=CC4=CC=CC=C43)O)O
InChI
InChI=1S/C22H18O2/c23-21(18-13-12-15-6-1-2-8-17(15)14-18)22(24)20-11-5-9-16-7-3-4-10-19(16)20/h1-14,21-24H/t21-,22-/m1/s1
InChIKey
RSFIBRKJSPSKFZ-FGZHOGPDSA-N
Compound name
(1R,2R)-1-naphthalen-1-yl-2-naphthalen-2-ylethane-1,2-diol
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

314.13068 Da
Monoisotopic Mass

4.4
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 315.137956 172.9
[M+Na]+ 337.119898 179.6
[M-H]- 313.123404 178.6
[M+NH4]+ 332.164503 187.3
[M+K]+ 353.093838 173.1
[M+H-H2O]+ 297.127940 164.5
[M+HCOO]- 359.128881 190.5
[M+CH3COO]- 373.144531 183.0
[M+Na-2H]- 335.105346 179.1
[M]+ 314.13013142 172.0
[M]- 314.13122858 172.0
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.