CID 3058889

75745-82-3

Structural Information

Molecular Formula
C14H14N2O4S
SMILES
COC1=CC=C(C=C1)S(=O)(=O)C2=CC=C(O2)C3=NCCN3
InChI
InChI=1S/C14H14N2O4S/c1-19-10-2-4-11(5-3-10)21(17,18)13-7-6-12(20-13)14-15-8-9-16-14/h2-7H,8-9H2,1H3,(H,15,16)
InChIKey
KVJOBUNTFPHCGK-UHFFFAOYSA-N
Compound name
2-[5-(4-methoxyphenyl)sulfonylfuran-2-yl]-4,5-dihydro-1H-imidazole
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

306.0674 Da
Monoisotopic Mass

1.4
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 307.07468 167.0
[M+Na]+ 329.05662 178.3
[M+NH4]+ 324.10122 173.3
[M+K]+ 345.03056 175.8
[M-H]- 305.06012 170.3
[M+Na-2H]- 327.04207 172.9
[M]+ 306.06685 169.9
[M]- 306.06795 169.9
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.