CID 12956612

31469-29-1

Structural Information

Molecular Formula
C7H14O2Si
SMILES
C[Si](C)(C)C1(CC1)C(=O)O
InChI
InChI=1S/C7H14O2Si/c1-10(2,3)7(4-5-7)6(8)9/h4-5H2,1-3H3,(H,8,9)
InChIKey
MKPDOHYDQLLZBU-UHFFFAOYSA-N
Compound name
1-trimethylsilylcyclopropane-1-carboxylic acid
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

26
Patents

158.07631 Da
Monoisotopic Mass

None
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 159.083586 132.1
[M+Na]+ 181.065528 141.1
[M-H]- 157.069034 135.8
[M+NH4]+ 176.110133 150.2
[M+K]+ 197.039468 140.2
[M+H-H2O]+ 141.073570 128.6
[M+HCOO]- 203.074511 151.9
[M+CH3COO]- 217.090161 176.5
[M+Na-2H]- 179.050976 138.8
[M]+ 158.07576142 135.1
[M]- 158.07685858 135.1
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