CID 71758037

4-[(tert-butyldimethylsilyl)oxy]naphthalene-2-carboxylic acid

Structural Information

Molecular Formula
C17H22O3Si
SMILES
CC(C)(C)[Si](C)(C)OC1=CC(=CC2=CC=CC=C21)C(=O)O
InChI
InChI=1S/C17H22O3Si/c1-17(2,3)21(4,5)20-15-11-13(16(18)19)10-12-8-6-7-9-14(12)15/h6-11H,1-5H3,(H,18,19)
InChIKey
DPISPHNFBRNEGA-UHFFFAOYSA-N
Compound name
4-[tert-butyl(dimethyl)silyl]oxynaphthalene-2-carboxylic acid
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

302.13382 Da
Monoisotopic Mass

None
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 303.14110 169.6
[M+Na]+ 325.12304 176.6
[M-H]- 301.12654 172.8
[M+NH4]+ 320.16764 186.1
[M+K]+ 341.09698 173.7
[M+H-H2O]+ 285.13108 163.9
[M+HCOO]- 347.13202 186.0
[M+CH3COO]- 361.14767 202.1
[M+Na-2H]- 323.10849 175.0
[M]+ 302.13327 172.4
[M]- 302.13437 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.