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]+ 303.141096 169.6
[M+Na]+ 325.123038 176.6
[M-H]- 301.126544 172.8
[M+NH4]+ 320.167643 186.1
[M+K]+ 341.096978 173.7
[M+H-H2O]+ 285.131080 163.9
[M+HCOO]- 347.132021 186.0
[M+CH3COO]- 361.147671 202.1
[M+Na-2H]- 323.108486 175.0
[M]+ 302.13327142 172.4
[M]- 302.13436858 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.