CID 3041841

6h-imidazo(4,5-g)benzothiazole, 2-amino-6-(2-morpholinoethyl)-, hydrochloride (2:5)

Structural Information

Molecular Formula
C14H17N5OS
SMILES
C1COCCN1CCN2C=NC3=C2C=CC4=C3SC(=N4)N
InChI
InChI=1S/C14H17N5OS/c15-14-17-10-1-2-11-12(13(10)21-14)16-9-19(11)4-3-18-5-7-20-8-6-18/h1-2,9H,3-8H2,(H2,15,17)
InChIKey
DIYYYZYZCKUUOL-UHFFFAOYSA-N
Compound name
6-(2-morpholin-4-ylethyl)imidazo[4,5-g][1,3]benzothiazol-2-amine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

303.1154 Da
Monoisotopic Mass

1.1
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 304.12268 164.7
[M+Na]+ 326.10462 176.2
[M-H]- 302.10812 169.6
[M+NH4]+ 321.14922 179.5
[M+K]+ 342.07856 171.8
[M+H-H2O]+ 286.11266 157.1
[M+HCOO]- 348.11360 179.1
[M+CH3COO]- 362.12925 176.3
[M+Na-2H]- 324.09007 166.9
[M]+ 303.11485 168.3
[M]- 303.11595 168.3
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.