CID 2125344

4-(morpholin-4-ylmethyl)-1,3-thiazol-2-amine

Structural Information

Molecular Formula
C8H13N3OS
SMILES
C1COCCN1CC2=CSC(=N2)N
InChI
InChI=1S/C8H13N3OS/c9-8-10-7(6-13-8)5-11-1-3-12-4-2-11/h6H,1-5H2,(H2,9,10)
InChIKey
GSAMTLRIAXVZHZ-UHFFFAOYSA-N
Compound name
4-(morpholin-4-ylmethyl)-1,3-thiazol-2-amine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

6
References

81
Patents

199.07793 Da
Monoisotopic Mass

0.1
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 200.08521 141.0
[M+Na]+ 222.06715 148.0
[M-H]- 198.07065 145.0
[M+NH4]+ 217.11175 158.0
[M+K]+ 238.04109 146.3
[M+H-H2O]+ 182.07519 133.5
[M+HCOO]- 244.07613 156.1
[M+CH3COO]- 258.09178 153.0
[M+Na-2H]- 220.05260 142.9
[M]+ 199.07738 138.6
[M]- 199.07848 138.6
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

Literature stripe

literature stripe

Patent stripe

patents stripe