CID 104054033

5-(1-methoxypropan-2-yl)-1,3-thiazol-2-amine

Structural Information

Molecular Formula
C7H12N2OS
SMILES
CC(COC)C1=CN=C(S1)N
InChI
InChI=1S/C7H12N2OS/c1-5(4-10-2)6-3-9-7(8)11-6/h3,5H,4H2,1-2H3,(H2,8,9)
InChIKey
IPDGAPCNCBLZAT-UHFFFAOYSA-N
Compound name
5-(1-methoxypropan-2-yl)-1,3-thiazol-2-amine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

172.06703 Da
Monoisotopic Mass

1.1
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 173.07431 135.8
[M+Na]+ 195.05625 144.1
[M-H]- 171.05975 138.2
[M+NH4]+ 190.10085 156.9
[M+K]+ 211.03019 142.4
[M+H-H2O]+ 155.06429 129.6
[M+HCOO]- 217.06523 154.7
[M+CH3COO]- 231.08088 179.9
[M+Na-2H]- 193.04170 136.7
[M]+ 172.06648 137.8
[M]- 172.06758 137.9
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.