CID 16494790

937662-77-6

Structural Information

Molecular Formula
C5H8N2OS
SMILES
COC1=NC=C(S1)CN
InChI
InChI=1S/C5H8N2OS/c1-8-5-7-3-4(2-6)9-5/h3H,2,6H2,1H3
InChIKey
JWUZBESCMDKWCP-UHFFFAOYSA-N
Compound name
(2-methoxy-1,3-thiazol-5-yl)methanamine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

23
Patents

144.03574 Da
Monoisotopic Mass

0.2
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 145.043016 126.0
[M+Na]+ 167.024958 135.5
[M-H]- 143.028464 128.7
[M+NH4]+ 162.069563 148.3
[M+K]+ 182.998898 133.9
[M+H-H2O]+ 127.033000 120.1
[M+HCOO]- 189.033941 146.6
[M+CH3COO]- 203.049591 173.1
[M+Na-2H]- 165.010406 129.1
[M]+ 144.03519142 128.0
[M]- 144.03628858 128.0
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