CID 2757372

18191-40-7

Structural Information

Molecular Formula
C3H8O5Si
SMILES
C(C[Si](O)(O)O)C(=O)O
InChI
InChI=1S/C3H8O5Si/c4-3(5)1-2-9(6,7)8/h6-8H,1-2H2,(H,4,5)
InChIKey
GDCRYMZNGGCWEH-UHFFFAOYSA-N
Compound name
3-trihydroxysilylpropanoic acid
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

5
References

1133
Patents

152.0141 Da
Monoisotopic Mass

None
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 153.02138 127.3
[M+Na]+ 175.00332 133.8
[M-H]- 151.00682 122.2
[M+NH4]+ 170.04792 146.0
[M+K]+ 190.97726 133.0
[M+H-H2O]+ 135.01136 123.7
[M+HCOO]- 197.01230 144.3
[M+CH3COO]- 211.02795 161.5
[M+Na-2H]- 172.98877 132.6
[M]+ 152.01355 125.5
[M]- 152.01465 125.5
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