CID 3051454

D 215

Structural Information

Molecular Formula
C19H25N3S
SMILES
CC(C)N(CCN1C2=CC=CC=C2SC3=C1N=CC=C3)C(C)C
InChI
InChI=1S/C19H25N3S/c1-14(2)21(15(3)4)12-13-22-16-8-5-6-9-17(16)23-18-10-7-11-20-19(18)22/h5-11,14-15H,12-13H2,1-4H3
InChIKey
VYNGCGSPXIAFMR-UHFFFAOYSA-N
Compound name
N-propan-2-yl-N-(2-pyrido[3,2-b][1,4]benzothiazin-10-ylethyl)propan-2-amine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

327.1769 Da
Monoisotopic Mass

4.6
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 328.18418 176.1
[M+Na]+ 350.16612 189.1
[M+NH4]+ 345.21072 185.4
[M+K]+ 366.14006 179.2
[M-H]- 326.16962 180.1
[M+Na-2H]- 348.15157 182.0
[M]+ 327.17635 179.7
[M]- 327.17745 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

No patent data available for this compound.