CID 217211

Brn 2480224

Structural Information

Molecular Formula
C24H18O2S
SMILES
C1=CC=C2C=C(C=CC2=C1)S(=O)CC3(C4=CC=CC=C4C5=CC=CC=C53)O
InChI
InChI=1S/C24H18O2S/c25-24(16-27(26)19-14-13-17-7-1-2-8-18(17)15-19)22-11-5-3-9-20(22)21-10-4-6-12-23(21)24/h1-15,25H,16H2
InChIKey
UQFQNHKXDAFHLD-UHFFFAOYSA-N
Compound name
9-(naphthalen-2-ylsulfinylmethyl)fluoren-9-ol
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

370.10275 Da
Monoisotopic Mass

4.8
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 371.11003 187.5
[M+Na]+ 393.09197 197.2
[M-H]- 369.09547 195.8
[M+NH4]+ 388.13657 206.2
[M+K]+ 409.06591 189.7
[M+H-H2O]+ 353.10001 180.0
[M+HCOO]- 415.10095 201.7
[M+CH3COO]- 429.11660 198.1
[M+Na-2H]- 391.07742 191.8
[M]+ 370.10220 190.9
[M]- 370.10330 190.9
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

No patent data available for this compound.