CID 51063728

1310405-24-3

Structural Information

Molecular Formula
C24H38BNO5
SMILES
B1(OC(C(O1)(C)C)(C)C)C2=CC=C(C=C2)OCCC3CCN(CC3)C(=O)OC(C)(C)C
InChI
InChI=1S/C24H38BNO5/c1-22(2,3)29-21(27)26-15-12-18(13-16-26)14-17-28-20-10-8-19(9-11-20)25-30-23(4,5)24(6,7)31-25/h8-11,18H,12-17H2,1-7H3
InChIKey
XMMKJMFBTRKXJE-UHFFFAOYSA-N
Compound name
tert-butyl 4-[2-[4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)phenoxy]ethyl]piperidine-1-carboxylate
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

431.2843 Da
Monoisotopic Mass

None
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 432.29158 202.0
[M+Na]+ 454.27352 211.1
[M+NH4]+ 449.31812 209.8
[M+K]+ 470.24746 205.2
[M-H]- 430.27702 207.0
[M+Na-2H]- 452.25897 207.3
[M]+ 431.28375 204.9
[M]- 431.28485 204.9
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.