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]+ 315.13796 172.9
[M+Na]+ 337.11990 179.6
[M-H]- 313.12340 178.6
[M+NH4]+ 332.16450 187.3
[M+K]+ 353.09384 173.1
[M+H-H2O]+ 297.12794 164.5
[M+HCOO]- 359.12888 190.5
[M+CH3COO]- 373.14453 183.0
[M+Na-2H]- 335.10535 179.1
[M]+ 314.13013 172.0
[M]- 314.13123 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.