CID 113917

Cyamepromazine maleate

Structural Information

Molecular Formula
C19H21N3S
SMILES
CC(CN1C2=C(C=C(C=C2)C#N)SC3=CC=CC=C31)CN(C)C
InChI
InChI=1S/C19H21N3S/c1-14(12-21(2)3)13-22-16-6-4-5-7-18(16)23-19-10-15(11-20)8-9-17(19)22/h4-10,14H,12-13H2,1-3H3
InChIKey
CBFLHGABMUCKLC-UHFFFAOYSA-N
Compound name
10-[3-(dimethylamino)-2-methylpropyl]phenothiazine-3-carbonitrile
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

2
Patents

323.14563 Da
Monoisotopic Mass

4.4
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 324.15291 180.4
[M+Na]+ 346.13485 189.8
[M-H]- 322.13835 184.1
[M+NH4]+ 341.17945 194.7
[M+K]+ 362.10879 182.7
[M+H-H2O]+ 306.14289 166.1
[M+HCOO]- 368.14383 190.7
[M+CH3COO]- 382.15948 188.9
[M+Na-2H]- 344.12030 182.2
[M]+ 323.14508 178.1
[M]- 323.14618 178.1
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

patents stripe