CID 10396874

1-methyl-2-(methylthio)-4,5-dihydro-1h-imidazole hydroiodide

Structural Information

Molecular Formula
C5H10N2S
SMILES
CN1CCN=C1SC
InChI
InChI=1S/C5H10N2S/c1-7-4-3-6-5(7)8-2/h3-4H2,1-2H3
InChIKey
PTFFWCHVBDAOMF-UHFFFAOYSA-N
Compound name
1-methyl-2-methylsulfanyl-4,5-dihydroimidazole
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

146
Patents

130.05647 Da
Monoisotopic Mass

0.4
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 131.06375 126.7
[M+Na]+ 153.04569 137.9
[M+NH4]+ 148.09029 135.8
[M+K]+ 169.01963 131.6
[M-H]- 129.04919 127.7
[M+Na-2H]- 151.03114 131.3
[M]+ 130.05592 128.9
[M]- 130.05702 128.9
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

Literature stripe

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Patent stripe

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