CID 2736127

N,n-dimethylindoline-5-sulfonamide

Structural Information

Molecular Formula

C₁₀H₁₄N₂O₂S

SMILES

CN(C)S(=O)(=O)C1=CC2=C(C=C1)NCC2

InChI

InChI=1S/C10H14N2O2S/c1-12(2)15(13,14)9-3-4-10-8(7-9)5-6-11-10/h3-4,7,11H,5-6H2,1-2H3

InChIKey

RTBHIQIVIFMZDZ-UHFFFAOYSA-N

Compound name

N,N-dimethyl-2,3-dihydro-1H-indole-5-sulfonamide

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 0
References: 63
Patents: 226.0776 Da
Monoisotopic Mass: 1.4
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]+	227.084876	148.3
[M+Na]+	249.066818	156.5
[M-H]-	225.070324	151.8
[M+NH4]+	244.111423	168.4
[M+K]+	265.040758	153.9
[M+H-H2O]+	209.074860	142.8
[M+HCOO]-	271.075801	164.6
[M+CH3COO]-	285.091451	188.1
[M+Na-2H]-	247.052266	152.3
[M]+	226.07705142	149.8
[M]-	226.07814858	149.8

Literature stripe

literature stripe

Patent stripe

patents stripe