CID 108493

60706-48-1

Structural Information

Molecular Formula
C19H22N2OS
SMILES
CN1CCCC(C1)N2C3=C(C=C(C=C3)OC)SC4=CC=CC=C42
InChI
InChI=1S/C19H22N2OS/c1-20-11-5-6-14(13-20)21-16-7-3-4-8-18(16)23-19-12-15(22-2)9-10-17(19)21/h3-4,7-10,12,14H,5-6,11,13H2,1-2H3
InChIKey
LUEVNSVASOZCPK-UHFFFAOYSA-N
Compound name
3-methoxy-10-(1-methylpiperidin-3-yl)phenothiazine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

326.1453 Da
Monoisotopic Mass

4.3
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 327.15258 175.1
[M+Na]+ 349.13452 190.5
[M+NH4]+ 344.17912 185.4
[M+K]+ 365.10846 179.1
[M-H]- 325.13802 180.9
[M+Na-2H]- 347.11997 182.2
[M]+ 326.14475 179.7
[M]- 326.14585 179.7
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