CID 3032310

Indoline-2-thione

Structural Information

Molecular Formula

SMILES

C1C2=CC=CC=C2NC1=S

InChI

InChI=1S/C8H7NS/c10-8-5-6-3-1-2-4-7(6)9-8/h1-4H,5H2,(H,9,10)

InChIKey

IGJWTYFTQNHSEK-UHFFFAOYSA-N

Compound name

1,3-dihydroindole-2-thione

Related CIDs

2D Structure

compound 2d structure

2
Annotation Hits: 14
References: 359
Patents: 149.02992 Da
Monoisotopic Mass: 1.8
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]+	150.03720	128.5
[M+Na]+	172.01914	140.9
[M+NH4]+	167.06374	138.8
[M+K]+	187.99308	133.5
[M-H]-	148.02264	130.7
[M+Na-2H]-	170.00459	133.9
[M]+	149.02937	131.3
[M]-	149.03047	131.3

Literature stripe

literature stripe

Patent stripe

patents stripe