CID 16684680

3-acetyl-2-methyl-2-phenyl-1,3,2-thiazagermolidine

Structural Information

Molecular Formula
C11H15GeNOS
SMILES
CC(=O)N1CCS[Ge]1(C)C2=CC=CC=C2
InChI
InChI=1S/C11H15GeNOS/c1-10(14)13-8-9-15-12(13,2)11-6-4-3-5-7-11/h3-7H,8-9H2,1-2H3
InChIKey
YGYVLVTWDMNFFE-UHFFFAOYSA-N
Compound name
1-(2-methyl-2-phenyl-1,3,2-thiazagermolidin-3-yl)ethanone
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

283.0086 Da
Monoisotopic Mass

None
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 284.01588 159.9
[M+Na]+ 305.99782 167.2
[M-H]- 282.00132 165.0
[M+NH4]+ 301.04242 180.7
[M+K]+ 321.97176 164.1
[M+H-H2O]+ 266.00586 153.2
[M+HCOO]- 328.00680 175.4
[M+CH3COO]- 342.02245 187.1
[M+Na-2H]- 303.98327 159.7
[M]+ 283.00805 160.0
[M]- 283.00915 160.0
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.