PubChemLite - Prochlorperazine (C20H24ClN3S)

Structural Information

Molecular Formula

SMILES

CN1CCN(CC1)CCCN2C3=CC=CC=C3SC4=C2C=C(C=C4)Cl

InChI

InChI=1S/C20H24ClN3S/c1-22-11-13-23(14-12-22)9-4-10-24-17-5-2-3-6-19(17)25-20-8-7-16(21)15-18(20)24/h2-3,5-8,15H,4,9-14H2,1H3

InChIKey

WIKYUJGCLQQFNW-UHFFFAOYSA-N

Compound name

2-chloro-10-[3-(4-methylpiperazin-1-yl)propyl]phenothiazine

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]+	374.14522	187.2
[M+Na]+	396.12716	203.5
[M+NH4]+	391.17176	197.3
[M+K]+	412.10110	190.6
[M-H]-	372.13066	192.6
[M+Na-2H]-	394.11261	193.9
[M]+	373.13739	192.1
[M]-	373.13849	192.1

Adduct

m/z

Predicted CCS (Å²)

[M+H]+

374.14522

187.2

[M+Na]+

396.12716

203.5

[M+NH4]+

391.17176

197.3

[M+K]+

412.10110

190.6

[M-H]-

372.13066

192.6

[M+Na-2H]-

394.11261

193.9

[M]+

373.13739

192.1

[M]-

373.13849

192.1

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

Prochlorperazine

Structural Information

2D Structure

Profile

Predicted Collision Cross Section

Literature stripe

Patent stripe