CID 14346754

111048-65-8

Structural Information

Molecular Formula

C₈H₁₀N₂O₂S

SMILES

C1CNC2=C1C=CC=C2S(=O)(=O)N

InChI

InChI=1S/C8H10N2O2S/c9-13(11,12)7-3-1-2-6-4-5-10-8(6)7/h1-3,10H,4-5H2,(H2,9,11,12)

InChIKey

HLLIZWSHMLSVLJ-UHFFFAOYSA-N

Compound name

2,3-dihydro-1H-indole-7-sulfonamide

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 0
References: 11
Patents: 198.0463 Da
Monoisotopic Mass: 0.5
XlogP (predicted)

Profile

Predicted Collision Cross Section

m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Å²) per adduct calculated using CCSbase.
Adduct	m/z	Predicted CCS (Å²)
[M+H]+	199.053576	139.6
[M+Na]+	221.035518	148.7
[M-H]-	197.039024	141.4
[M+NH4]+	216.080123	159.9
[M+K]+	237.009458	144.6
[M+H-H2O]+	181.043560	134.6
[M+HCOO]-	243.044501	155.4
[M+CH3COO]-	257.060151	178.1
[M+Na-2H]-	219.020966	144.3
[M]+	198.04575142	138.1
[M]-	198.04684858	138.1

Literature stripe

No literature data available for this compound.

Patent stripe

patents stripe