CID 3055368

2-((1-(9h-fluoren-2-yl)ethyl)sulfinyl)acetamide

Structural Information

Molecular Formula
C17H17NO2S
SMILES
CC(C1=CC2=C(C=C1)C3=CC=CC=C3C2)S(=O)CC(=O)N
InChI
InChI=1S/C17H17NO2S/c1-11(21(20)10-17(18)19)12-6-7-16-14(8-12)9-13-4-2-3-5-15(13)16/h2-8,11H,9-10H2,1H3,(H2,18,19)
InChIKey
VUFLRXYSLCBTMK-UHFFFAOYSA-N
Compound name
2-[1-(9H-fluoren-2-yl)ethylsulfinyl]acetamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

1
Patents

299.098 Da
Monoisotopic Mass

2.1
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 300.10528 168.8
[M+Na]+ 322.08722 176.0
[M-H]- 298.09072 173.7
[M+NH4]+ 317.13182 187.7
[M+K]+ 338.06116 171.5
[M+H-H2O]+ 282.09526 163.0
[M+HCOO]- 344.09620 184.0
[M+CH3COO]- 358.11185 205.7
[M+Na-2H]- 320.07267 168.9
[M]+ 299.09745 171.2
[M]- 299.09855 171.2
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

patents stripe