CID 22070623

2,3-dihydro-1h-indole-1-sulfonamide

Structural Information

Molecular Formula
C8H10N2O2S
SMILES
C1CN(C2=CC=CC=C21)S(=O)(=O)N
InChI
InChI=1S/C8H10N2O2S/c9-13(11,12)10-6-5-7-3-1-2-4-8(7)10/h1-4H,5-6H2,(H2,9,11,12)
InChIKey
IWPJHISUYDXHGJ-UHFFFAOYSA-N
Compound name
2,3-dihydroindole-1-sulfonamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

2
References

110
Patents

198.0463 Da
Monoisotopic Mass

0.4
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 199.053576 139.5
[M+Na]+ 221.035518 149.0
[M-H]- 197.039024 142.8
[M+NH4]+ 216.080123 160.6
[M+K]+ 237.009458 145.9
[M+H-H2O]+ 181.043560 134.3
[M+HCOO]- 243.044501 156.9
[M+CH3COO]- 257.060151 180.6
[M+Na-2H]- 219.020966 144.6
[M]+ 198.04575142 139.9
[M]- 198.04684858 139.9
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

Literature stripe

literature stripe

Patent stripe

patents stripe