CID 674456

4-cyclopropyl-1,3-thiazol-2-amine

Structural Information

Molecular Formula
C6H8N2S
SMILES
C1CC1C2=CSC(=N2)N
InChI
InChI=1S/C6H8N2S/c7-6-8-5(3-9-6)4-1-2-4/h3-4H,1-2H2,(H2,7,8)
InChIKey
FGPNVCRMNYEMEP-UHFFFAOYSA-N
Compound name
4-cyclopropyl-1,3-thiazol-2-amine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

217
Patents

140.04082 Da
Monoisotopic Mass

1.2
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 141.04810 121.9
[M+Na]+ 163.03004 132.9
[M-H]- 139.03354 128.4
[M+NH4]+ 158.07464 139.5
[M+K]+ 179.00398 129.4
[M+H-H2O]+ 123.03808 115.6
[M+HCOO]- 185.03902 142.7
[M+CH3COO]- 199.05467 136.3
[M+Na-2H]- 161.01549 125.4
[M]+ 140.04027 124.0
[M]- 140.04137 124.0
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