PubChemLite - Ly-367,265 (C24H25FN4O2S)

Structural Information

Molecular Formula

SMILES

C1CC2=C3C(=CC=C2)N(S(=O)(=O)N3C1)CCN4CCC(=CC4)C5=CNC6=C5C=CC(=C6)F

InChI

InChI=1S/C24H25FN4O2S/c25-19-6-7-20-21(16-26-22(20)15-19)17-8-11-27(12-9-17)13-14-28-23-5-1-3-18-4-2-10-29(24(18)23)32(28,30)31/h1,3,5-8,15-16,26H,2,4,9-14H2

InChIKey

BJIPVHLRWSDKOS-UHFFFAOYSA-N

Compound name

3-[2-[4-(6-fluoro-1H-indol-3-yl)-3,6-dihydro-2H-pyridin-1-yl]ethyl]-2lambda6-thia-1,3-diazatricyclo[6.3.1.04,12]dodeca-4,6,8(12)-triene 2,2-dioxide

Related CIDs

2D Structure

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]+	453.17548	204.5
[M+Na]+	475.15742	217.8
[M+NH4]+	470.20202	213.0
[M+K]+	491.13136	209.2
[M-H]-	451.16092	207.2
[M+Na-2H]-	473.14287	209.2
[M]+	452.16765	207.7
[M]-	452.16875	207.7

Adduct

m/z

Predicted CCS (Å²)

[M+H]+

453.17548

204.5

[M+Na]+

475.15742

217.8

[M+NH4]+

470.20202

213.0

[M+K]+

491.13136

209.2

[M-H]-

451.16092

207.2

[M+Na-2H]-

473.14287

209.2

[M]+

452.16765

207.7

[M]-

452.16875

207.7

m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Å²) per adduct calculated using CCSbase.

Ly-367,265

Structural Information

2D Structure

Profile

Predicted Collision Cross Section

Literature stripe

Patent stripe