CID 18939834

144163-68-8

Structural Information

Molecular Formula
C5H8N2S
SMILES
CNCC1=NC=CS1
InChI
InChI=1S/C5H8N2S/c1-6-4-5-7-2-3-8-5/h2-3,6H,4H2,1H3
InChIKey
MNHGOWYUJYMPGV-UHFFFAOYSA-N
Compound name
N-methyl-1-(1,3-thiazol-2-yl)methanamine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

1
References

158
Patents

128.04082 Da
Monoisotopic Mass

0.4
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 129.04810 123.9
[M+Na]+ 151.03004 134.6
[M+NH4]+ 146.07464 133.4
[M+K]+ 167.00398 128.2
[M-H]- 127.03354 126.1
[M+Na-2H]- 149.01549 130.0
[M]+ 128.04027 126.4
[M]- 128.04137 126.4
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