CID 45790007

1264198-72-2

Structural Information

Molecular Formula
C12H24BNO2
SMILES
B1(OC(C(O1)(C)C)(C)C)C2CCN(CC2)C
InChI
InChI=1S/C12H24BNO2/c1-11(2)12(3,4)16-13(15-11)10-6-8-14(5)9-7-10/h10H,6-9H2,1-5H3
InChIKey
IMLCYAZBMGOKQS-UHFFFAOYSA-N
Compound name
1-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

1
Patents

225.19 Da
Monoisotopic Mass

None
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 226.19728 149.0
[M+Na]+ 248.17922 155.8
[M-H]- 224.18272 155.3
[M+NH4]+ 243.22382 169.5
[M+K]+ 264.15316 156.9
[M+H-H2O]+ 208.18726 144.0
[M+HCOO]- 270.18820 164.7
[M+CH3COO]- 284.20385 189.7
[M+Na-2H]- 246.16467 152.6
[M]+ 225.18945 147.9
[M]- 225.19055 147.9
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