CID 24352

Propionylpromazine

Structural Information

Molecular Formula
C20H24N2OS
SMILES
CCC(=O)C1=CC2=C(C=C1)SC3=CC=CC=C3N2CCCN(C)C
InChI
InChI=1S/C20H24N2OS/c1-4-18(23)15-10-11-20-17(14-15)22(13-7-12-21(2)3)16-8-5-6-9-19(16)24-20/h5-6,8-11,14H,4,7,12-13H2,1-3H3
InChIKey
ZQTVCQIJTREKSP-UHFFFAOYSA-N
Compound name
1-[10-[3-(dimethylamino)propyl]phenothiazin-2-yl]propan-1-one
Related CIDs

2D Structure

compound 2d structure
4
Annotation Hits

56
References

123
Patents

340.16095 Da
Monoisotopic Mass

4.7
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 341.16823 179.7
[M+Na]+ 363.15017 192.9
[M+NH4]+ 358.19477 188.9
[M+K]+ 379.12411 182.4
[M-H]- 339.15367 184.0
[M+Na-2H]- 361.13562 185.4
[M]+ 340.16040 183.4
[M]- 340.16150 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

literature stripe

Patent stripe

patents stripe