CID 75486231

1425335-44-9

Structural Information

Molecular Formula
C17H32BNO4
SMILES
B1(OC(C(O1)(C)C)(C)C)CC2CCN(CC2)C(=O)OC(C)(C)C
InChI
InChI=1S/C17H32BNO4/c1-15(2,3)21-14(20)19-10-8-13(9-11-19)12-18-22-16(4,5)17(6,7)23-18/h13H,8-12H2,1-7H3
InChIKey
QMQDGWLWXYJXGH-UHFFFAOYSA-N
Compound name
tert-butyl 4-[(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)methyl]piperidine-1-carboxylate
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

15
Patents

325.24243 Da
Monoisotopic Mass

None
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 326.24971 174.7
[M+Na]+ 348.23165 179.8
[M-H]- 324.23515 180.5
[M+NH4]+ 343.27625 191.1
[M+K]+ 364.20559 181.4
[M+H-H2O]+ 308.23969 170.2
[M+HCOO]- 370.24063 186.8
[M+CH3COO]- 384.25628 207.6
[M+Na-2H]- 346.21710 176.6
[M]+ 325.24188 176.4
[M]- 325.24298 176.4
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