CID 16684645

2,2-dipentyl-5-methyl-1,3,2-thiazagermolidine

Structural Information

Molecular Formula
C13H29GeNS
SMILES
CCCCC[Ge]1(NCC(S1)C)CCCCC
InChI
InChI=1S/C13H29GeNS/c1-4-6-8-10-14(11-9-7-5-2)15-12-13(3)16-14/h13,15H,4-12H2,1-3H3
InChIKey
ONKWXMOZIHJLTH-UHFFFAOYSA-N
Compound name
5-methyl-2,2-dipentyl-1,3,2-thiazagermolidine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

305.12326 Da
Monoisotopic Mass

None
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 306.13054 171.2
[M+Na]+ 328.11248 175.6
[M-H]- 304.11598 170.4
[M+NH4]+ 323.15708 190.7
[M+K]+ 344.08642 171.4
[M+H-H2O]+ 288.12052 164.9
[M+HCOO]- 350.12146 183.3
[M+CH3COO]- 364.13711 193.8
[M+Na-2H]- 326.09793 168.3
[M]+ 305.12271 172.4
[M]- 305.12381 172.4
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.