CID 1522244

2360-22-7

Structural Information

Molecular Formula
C8H8N2S
SMILES
CN1C2=CC=CC=C2NC1=S
InChI
InChI=1S/C8H8N2S/c1-10-7-5-3-2-4-6(7)9-8(10)11/h2-5H,1H3,(H,9,11)
InChIKey
CDNHLXOFELOEOL-UHFFFAOYSA-N
Compound name
3-methyl-1H-benzimidazole-2-thione
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

13
References

807
Patents

164.04082 Da
Monoisotopic Mass

1.3
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 165.04810 131.3
[M+Na]+ 187.03004 145.6
[M+NH4]+ 182.07464 140.8
[M+K]+ 203.00398 138.2
[M-H]- 163.03354 133.0
[M+Na-2H]- 185.01549 137.6
[M]+ 164.04027 134.3
[M]- 164.04137 134.3
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