CID 59151313

955978-85-5

Structural Information

Molecular Formula
C14H17BFNO2
SMILES
B1(OC(C(O1)(C)C)(C)C)C2=CC(=CC3=C2C=CN3)F
InChI
InChI=1S/C14H17BFNO2/c1-13(2)14(3,4)19-15(18-13)11-7-9(16)8-12-10(11)5-6-17-12/h5-8,17H,1-4H3
InChIKey
ULVDSUCFEQPJSB-UHFFFAOYSA-N
Compound name
6-fluoro-4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)-1H-indole
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

110
Patents

261.13364 Da
Monoisotopic Mass

None
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 262.14092 155.5
[M+Na]+ 284.12286 168.0
[M+NH4]+ 279.16746 166.1
[M+K]+ 300.09680 162.3
[M-H]- 260.12636 159.5
[M+Na-2H]- 282.10831 162.1
[M]+ 261.13309 158.7
[M]- 261.13419 158.7
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