CID 86619050

5-(oxan-4-yl)-1,3-thiazol-2-amine

Structural Information

Molecular Formula
C8H12N2OS
SMILES
C1COCCC1C2=CN=C(S2)N
InChI
InChI=1S/C8H12N2OS/c9-8-10-5-7(12-8)6-1-3-11-4-2-6/h5-6H,1-4H2,(H2,9,10)
InChIKey
IIJTWTZHFYALOC-UHFFFAOYSA-N
Compound name
5-(oxan-4-yl)-1,3-thiazol-2-amine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

41
Patents

184.06703 Da
Monoisotopic Mass

1.0
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 185.074306 137.1
[M+Na]+ 207.056248 144.0
[M-H]- 183.059754 142.6
[M+NH4]+ 202.100853 156.1
[M+K]+ 223.030188 142.5
[M+H-H2O]+ 167.064290 130.6
[M+HCOO]- 229.065231 153.5
[M+CH3COO]- 243.080881 149.9
[M+Na-2H]- 205.041696 139.2
[M]+ 184.06648142 134.2
[M]- 184.06757858 134.2
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