CID 3064151

101976-50-5

Structural Information

Molecular Formula
C19H22N2S
SMILES
CC1=CC2=C(C=C1)N(C3=CC=CC=C3S2)C4CCCN(C4)C
InChI
InChI=1S/C19H22N2S/c1-14-9-10-17-19(12-14)22-18-8-4-3-7-16(18)21(17)15-6-5-11-20(2)13-15/h3-4,7-10,12,15H,5-6,11,13H2,1-2H3
InChIKey
NBHFJJYNKNZDEA-UHFFFAOYSA-N
Compound name
3-methyl-10-(1-methylpiperidin-3-yl)phenothiazine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

310.15036 Da
Monoisotopic Mass

4.7
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 311.15764 171.8
[M+Na]+ 333.13958 187.6
[M+NH4]+ 328.18418 182.7
[M+K]+ 349.11352 175.7
[M-H]- 309.14308 178.1
[M+Na-2H]- 331.12503 179.2
[M]+ 310.14981 176.6
[M]- 310.15091 176.6
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.