CID 155973056

2169128-34-9

Structural Information

Molecular Formula
C8H8FNO2S
SMILES
C1CNC2=C1C=C(C=C2)S(=O)(=O)F
InChI
InChI=1S/C8H8FNO2S/c9-13(11,12)7-1-2-8-6(5-7)3-4-10-8/h1-2,5,10H,3-4H2
InChIKey
BOFQQSGOUFTRQZ-UHFFFAOYSA-N
Compound name
2,3-dihydro-1H-indole-5-sulfonyl fluoride
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

201.02597 Da
Monoisotopic Mass

2.0
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 202.03325 138.4
[M+Na]+ 224.01519 148.4
[M-H]- 200.01869 139.5
[M+NH4]+ 219.05979 159.2
[M+K]+ 239.98913 144.5
[M+H-H2O]+ 184.02323 132.8
[M+HCOO]- 246.02417 152.9
[M+CH3COO]- 260.03982 176.5
[M+Na-2H]- 222.00064 142.7
[M]+ 201.02542 137.6
[M]- 201.02652 137.6
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.