CID 218475

Sulfide, bis(2-(2-naphthoxy)ethyl)

Structural Information

Molecular Formula
C24H22O2S
SMILES
C1=CC=C2C=C(C=CC2=C1)OCCSCCOC3=CC4=CC=CC=C4C=C3
InChI
InChI=1S/C24H22O2S/c1-3-7-21-17-23(11-9-19(21)5-1)25-13-15-27-16-14-26-24-12-10-20-6-2-4-8-22(20)18-24/h1-12,17-18H,13-16H2
InChIKey
DVPHHWUIZPNFQQ-UHFFFAOYSA-N
Compound name
2-[2-(2-naphthalen-2-yloxyethylsulfanyl)ethoxy]naphthalene
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

374.13406 Da
Monoisotopic Mass

6.7
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 375.14134 187.9
[M+Na]+ 397.12328 195.8
[M-H]- 373.12678 195.7
[M+NH4]+ 392.16788 202.2
[M+K]+ 413.09722 188.8
[M+H-H2O]+ 357.13132 178.5
[M+HCOO]- 419.13226 205.2
[M+CH3COO]- 433.14791 198.1
[M+Na-2H]- 395.10873 194.0
[M]+ 374.13351 194.7
[M]- 374.13461 194.7
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.