CID 84648965

(3-methoxy-1,2-thiazol-4-yl)methanaminehydrochloride

Structural Information

Molecular Formula
C5H8N2OS
SMILES
COC1=NSC=C1CN
InChI
InChI=1S/C5H8N2OS/c1-8-5-4(2-6)3-9-7-5/h3H,2,6H2,1H3
InChIKey
WKAGSGQGFXVWJD-UHFFFAOYSA-N
Compound name
(3-methoxy-1,2-thiazol-4-yl)methanamine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

144.03574 Da
Monoisotopic Mass

0.1
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 145.04302 127.3
[M+Na]+ 167.02496 137.5
[M+NH4]+ 162.06956 136.1
[M+K]+ 182.99890 132.1
[M-H]- 143.02846 128.8
[M+Na-2H]- 165.01041 132.2
[M]+ 144.03519 129.4
[M]- 144.03629 129.4
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.