CID 137964005

Methyl({[4-(tetramethyl-1,3,2-dioxaborolan-2-yl)furan-2-yl]methyl})amine hydrochloride

Structural Information

Molecular Formula
C12H20BNO3
SMILES
B1(OC(C(O1)(C)C)(C)C)C2=COC(=C2)CNC
InChI
InChI=1S/C12H20BNO3/c1-11(2)12(3,4)17-13(16-11)9-6-10(7-14-5)15-8-9/h6,8,14H,7H2,1-5H3
InChIKey
QUZQBFXGSOKFOM-UHFFFAOYSA-N
Compound name
N-methyl-1-[4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)furan-2-yl]methanamine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

237.15363 Da
Monoisotopic Mass

None
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 238.16091 149.4
[M+Na]+ 260.14285 159.4
[M+NH4]+ 255.18745 159.7
[M+K]+ 276.11679 155.5
[M-H]- 236.14635 155.9
[M+Na-2H]- 258.12830 155.5
[M]+ 237.15308 152.9
[M]- 237.15418 152.9
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

No patent data available for this compound.