CID 23574121

952604-30-7

Structural Information

Molecular Formula
C26H19BO2
SMILES
B(C1=CC=C(C=C1)C2=C3C=CC=CC3=C(C4=CC=CC=C42)C5=CC=CC=C5)(O)O
InChI
InChI=1S/C26H19BO2/c28-27(29)20-16-14-19(15-17-20)26-23-12-6-4-10-21(23)25(18-8-2-1-3-9-18)22-11-5-7-13-24(22)26/h1-17,28-29H
InChIKey
YNDGEMZBYUVHTH-UHFFFAOYSA-N
Compound name
[4-(10-phenylanthracen-9-yl)phenyl]boronic acid
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

181
Patents

374.1478 Da
Monoisotopic Mass

None
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 375.15508 192.0
[M+Na]+ 397.13702 212.1
[M+NH4]+ 392.18162 202.3
[M+K]+ 413.11096 200.5
[M-H]- 373.14052 201.2
[M+Na-2H]- 395.12247 204.4
[M]+ 374.14725 198.1
[M]- 374.14835 198.1
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