CID 3051467

67465-80-9

Structural Information

Molecular Formula
C19H23N3S
SMILES
CC(CN1C2=CC=CC=C2SC3=C1N=CC=C3)N4CCCCC4
InChI
InChI=1S/C19H23N3S/c1-15(21-12-5-2-6-13-21)14-22-16-8-3-4-9-17(16)23-18-10-7-11-20-19(18)22/h3-4,7-11,15H,2,5-6,12-14H2,1H3
InChIKey
SFOIYGRFPPJSRQ-UHFFFAOYSA-N
Compound name
10-(2-piperidin-1-ylpropyl)pyrido[3,2-b][1,4]benzothiazine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

325.16125 Da
Monoisotopic Mass

4.3
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 326.16853 174.8
[M+Na]+ 348.15047 189.3
[M+NH4]+ 343.19507 184.7
[M+K]+ 364.12441 178.1
[M-H]- 324.15397 179.9
[M+Na-2H]- 346.13592 182.0
[M]+ 325.16070 178.9
[M]- 325.16180 178.9
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.