CID 11814078

126949-60-8

Structural Information

Molecular Formula
C24H34Cl2MoN2
SMILES
CC(C)C1=C(C(=CC=C1)C(C)C)N=[Mo](=NC2=C(C=CC=C2C(C)C)C(C)C)(Cl)Cl
InChI
InChI=1S/2C12H17N.2ClH.Mo/c2*1-8(2)10-6-5-7-11(9(3)4)12(10)13;;;/h2*5-9H,1-4H3;2*1H;/q;;;;+2/p-2
InChIKey
OFEYGPIXSLUEIE-UHFFFAOYSA-L
Compound name
dichloro-bis[[2,6-di(propan-2-yl)phenyl]imino]molybdenum
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

518.1153 Da
Monoisotopic Mass

None
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 519.12258 222.8
[M+Na]+ 541.10452 235.8
[M+NH4]+ 536.14912 229.9
[M+K]+ 557.07846 226.2
[M-H]- 517.10802 227.8
[M+Na-2H]- 539.08997 228.3
[M]+ 518.11475 226.9
[M]- 518.11585 226.9
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

No patent data available for this compound.