CID 77273

Dichlorpromazine

Structural Information

Molecular Formula
C17H18Cl2N2S
SMILES
CN(C)CCCN1C2=CC=CC=C2SC3=C1C=C(C=C3Cl)Cl
InChI
InChI=1S/C17H18Cl2N2S/c1-20(2)8-5-9-21-14-6-3-4-7-16(14)22-17-13(19)10-12(18)11-15(17)21/h3-4,6-7,10-11H,5,8-9H2,1-2H3
InChIKey
BRABGWAAPWTHSE-UHFFFAOYSA-N
Compound name
3-(2,4-dichlorophenothiazin-10-yl)-N,N-dimethylpropan-1-amine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

352.05676 Da
Monoisotopic Mass

5.8
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 353.06404 178.2
[M+Na]+ 375.04598 194.6
[M+NH4]+ 370.09058 189.1
[M+K]+ 391.01992 181.9
[M-H]- 351.04948 183.4
[M+Na-2H]- 373.03143 185.0
[M]+ 352.05621 183.4
[M]- 352.05731 183.4
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

Literature stripe

No literature data available for this compound.

Patent stripe

No patent data available for this compound.