CID 72287

Levomepromazine

Structural Information

Molecular Formula
C19H24N2OS
SMILES
C[C@@H](CN1C2=CC=CC=C2SC3=C1C=C(C=C3)OC)CN(C)C
InChI
InChI=1S/C19H24N2OS/c1-14(12-20(2)3)13-21-16-7-5-6-8-18(16)23-19-10-9-15(22-4)11-17(19)21/h5-11,14H,12-13H2,1-4H3/t14-/m1/s1
InChIKey
VRQVVMDWGGWHTJ-CQSZACIVSA-N
Compound name
(2R)-3-(2-methoxyphenothiazin-10-yl)-N,N,2-trimethylpropan-1-amine
Related CIDs

2D Structure

compound 2d structure
6
Annotation Hits

960
References

11733
Patents

328.16095 Da
Monoisotopic Mass

4.7
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 329.16823 176.0
[M+Na]+ 351.15017 189.4
[M+NH4]+ 346.19477 185.7
[M+K]+ 367.12411 179.2
[M-H]- 327.15367 180.6
[M+Na-2H]- 349.13562 182.0
[M]+ 328.16040 179.9
[M]- 328.16150 179.9
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