CID 14391647

Bicyclo[2.2.1]hept-5-ene-2-carboxylic acid, trimethylsilyl ester

Structural Information

Molecular Formula
C11H18O2Si
SMILES
C[Si](C)(C)OC(=O)C1CC2CC1C=C2
InChI
InChI=1S/C11H18O2Si/c1-14(2,3)13-11(12)10-7-8-4-5-9(10)6-8/h4-5,8-10H,6-7H2,1-3H3
InChIKey
YDOFALGSXSUFFA-UHFFFAOYSA-N
Compound name
trimethylsilyl bicyclo[2.2.1]hept-5-ene-2-carboxylate
Related CIDs

2D Structure

compound 2d structure
2
Annotation Hits

0
References

73
Patents

210.1076 Da
Monoisotopic Mass

None
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 211.11488 150.1
[M+Na]+ 233.09682 157.1
[M-H]- 209.10032 153.0
[M+NH4]+ 228.14142 174.9
[M+K]+ 249.07076 155.7
[M+H-H2O]+ 193.10486 146.4
[M+HCOO]- 255.10580 169.8
[M+CH3COO]- 269.12145 185.1
[M+Na-2H]- 231.08227 152.8
[M]+ 210.10705 151.8
[M]- 210.10815 151.8
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

patents stripe