CID 14823

Molybdenum disulfide

Structural Information

Molecular Formula
MoS2
SMILES
S=[Mo]=S
InChI
InChI=1S/Mo.2S
InChIKey
CWQXQMHSOZUFJS-UHFFFAOYSA-N
Compound name
bis(sulfanylidene)molybdenum
Related CIDs

2D Structure

compound 2d structure
6
Annotation Hits

1163
References

46158
Patents

161.84955 Da
Monoisotopic Mass

None
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 162.856826 121.1
[M+Na]+ 184.838768 130.3
[M-H]- 160.842274 121.7
[M+NH4]+ 179.883373 145.0
[M+K]+ 200.812708 127.2
[M+H-H2O]+ 144.846810 116.4
[M+HCOO]- 206.847751 134.3
[M+CH3COO]- 220.863401 162.8
[M+Na-2H]- 182.824216 122.5
[M]+ 161.84900142 121.8
[M]- 161.85009858 121.8
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