CID 45083492

300768-05-2

Structural Information

Molecular Formula
C5H5NO2S
SMILES
COC1=NSC(=C1)C=O
InChI
InChI=1S/C5H5NO2S/c1-8-5-2-4(3-7)9-6-5/h2-3H,1H3
InChIKey
BFOZCSISIDTCFT-UHFFFAOYSA-N
Compound name
3-methoxy-1,2-thiazole-5-carbaldehyde
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

2
Patents

143.0041 Da
Monoisotopic Mass

1.1
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 144.01138 127.3
[M+Na]+ 165.99332 138.6
[M+NH4]+ 161.03792 135.8
[M+K]+ 181.96726 132.9
[M-H]- 141.99682 128.0
[M+Na-2H]- 163.97877 132.2
[M]+ 143.00355 129.4
[M]- 143.00465 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

patents stripe