CID 2773617

330793-09-4

Structural Information

Molecular Formula
C17H26BNO4
SMILES
B1(OC(C(O1)(C)C)(C)C)C2=CC(=CC=C2)NC(=O)OC(C)(C)C
InChI
InChI=1S/C17H26BNO4/c1-15(2,3)21-14(20)19-13-10-8-9-12(11-13)18-22-16(4,5)17(6,7)23-18/h8-11H,1-7H3,(H,19,20)
InChIKey
ANQAOGOIWVMGCH-UHFFFAOYSA-N
Compound name
tert-butyl N-[3-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)phenyl]carbamate
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

127
Patents

319.1955 Da
Monoisotopic Mass

None
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 320.20278 171.9
[M+Na]+ 342.18472 181.4
[M+NH4]+ 337.22932 180.7
[M+K]+ 358.15866 176.2
[M-H]- 318.18822 176.3
[M+Na-2H]- 340.17017 178.3
[M]+ 319.19495 174.8
[M]- 319.19605 174.8
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