CID 64578

2-(adamantyldimethylgermyl)propionic acid

Structural Information

Molecular Formula
C15H26GeO2
SMILES
CC(C(=O)O)[Ge](C)(C)C12CC3CC(C1)CC(C3)C2
InChI
InChI=1S/C15H26GeO2/c1-10(14(17)18)16(2,3)15-7-11-4-12(8-15)6-13(5-11)9-15/h10-13H,4-9H2,1-3H3,(H,17,18)
InChIKey
UGSUODSTZPJRAB-UHFFFAOYSA-N
Compound name
2-[1-adamantyl(dimethyl)germyl]propanoic acid
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

312.11447 Da
Monoisotopic Mass

None
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 313.12175 178.0
[M+Na]+ 335.10369 177.6
[M-H]- 311.10719 170.7
[M+NH4]+ 330.14829 200.5
[M+K]+ 351.07763 174.6
[M+H-H2O]+ 295.11173 172.6
[M+HCOO]- 357.11267 178.6
[M+CH3COO]- 371.12832 204.4
[M+Na-2H]- 333.08914 184.4
[M]+ 312.11392 177.3
[M]- 312.11502 177.3
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

No patent data available for this compound.