CID 73994620

N-[(4-methylmorpholin-2-yl)methyl]-1,3-thiazol-2-amine

Structural Information

Molecular Formula
C9H15N3OS
SMILES
CN1CCOC(C1)CNC2=NC=CS2
InChI
InChI=1S/C9H15N3OS/c1-12-3-4-13-8(7-12)6-11-9-10-2-5-14-9/h2,5,8H,3-4,6-7H2,1H3,(H,10,11)
InChIKey
ZGXKOJCCDSYBKF-UHFFFAOYSA-N
Compound name
N-[(4-methylmorpholin-2-yl)methyl]-1,3-thiazol-2-amine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

2
Patents

213.09358 Da
Monoisotopic Mass

1.0
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 214.100856 145.1
[M+Na]+ 236.082798 151.6
[M-H]- 212.086304 149.5
[M+NH4]+ 231.127403 161.9
[M+K]+ 252.056738 150.1
[M+H-H2O]+ 196.090840 137.5
[M+HCOO]- 258.091781 160.6
[M+CH3COO]- 272.107431 157.0
[M+Na-2H]- 234.068246 147.5
[M]+ 213.09303142 144.0
[M]- 213.09412858 144.0
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