CID 67445786

1415794-16-9

Structural Information

Molecular Formula
C17H26BNO2
SMILES
B1(OC(C(O1)(C)C)(C)C)C2=CC=C(C=C2)C3CCNCC3
InChI
InChI=1S/C17H26BNO2/c1-16(2)17(3,4)21-18(20-16)15-7-5-13(6-8-15)14-9-11-19-12-10-14/h5-8,14,19H,9-12H2,1-4H3
InChIKey
ZNVSPUGMUVHHPW-UHFFFAOYSA-N
Compound name
4-[4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)phenyl]piperidine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

40
Patents

287.20566 Da
Monoisotopic Mass

None
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 288.212936 167.4
[M+Na]+ 310.194878 173.2
[M-H]- 286.198384 175.3
[M+NH4]+ 305.239483 184.1
[M+K]+ 326.168818 171.6
[M+H-H2O]+ 270.202920 160.4
[M+HCOO]- 332.203861 181.4
[M+CH3COO]- 346.219511 178.2
[M+Na-2H]- 308.180326 169.5
[M]+ 287.20511142 163.7
[M]- 287.20620858 163.7
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