CID 161911498

4-methyl-4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)piperidine hydrochloride

Structural Information

Molecular Formula
C12H24BNO2
SMILES
B1(OC(C(O1)(C)C)(C)C)C2(CCNCC2)C
InChI
InChI=1S/C12H24BNO2/c1-10(2)11(3,4)16-13(15-10)12(5)6-8-14-9-7-12/h14H,6-9H2,1-5H3
InChIKey
HNVFADHJNYQINJ-UHFFFAOYSA-N
Compound name
4-methyl-4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)piperidine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

225.19 Da
Monoisotopic Mass

None
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 226.19728 148.0
[M+Na]+ 248.17922 154.5
[M-H]- 224.18272 153.0
[M+NH4]+ 243.22382 169.4
[M+K]+ 264.15316 154.9
[M+H-H2O]+ 208.18726 143.7
[M+HCOO]- 270.18820 162.2
[M+CH3COO]- 284.20385 186.0
[M+Na-2H]- 246.16467 153.1
[M]+ 225.18945 145.2
[M]- 225.19055 145.2
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

No patent data available for this compound.