CID 72220968

Dimethyl(2-{[5-(tetramethyl-1,3,2-dioxaborolan-2-yl)pyridin-3-yl]oxy}ethyl)amine

Structural Information

Molecular Formula
C15H25BN2O3
SMILES
B1(OC(C(O1)(C)C)(C)C)C2=CC(=CN=C2)OCCN(C)C
InChI
InChI=1S/C15H25BN2O3/c1-14(2)15(3,4)21-16(20-14)12-9-13(11-17-10-12)19-8-7-18(5)6/h9-11H,7-8H2,1-6H3
InChIKey
JBTPTRDTRCXFMA-UHFFFAOYSA-N
Compound name
N,N-dimethyl-2-[5-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)pyridin-3-yl]oxyethanamine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

292.19583 Da
Monoisotopic Mass

None
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 293.20311 165.0
[M+Na]+ 315.18505 172.7
[M-H]- 291.18855 173.3
[M+NH4]+ 310.22965 183.1
[M+K]+ 331.15899 174.3
[M+H-H2O]+ 275.19309 158.7
[M+HCOO]- 337.19403 185.7
[M+CH3COO]- 351.20968 207.9
[M+Na-2H]- 313.17050 169.8
[M]+ 292.19528 171.2
[M]- 292.19638 171.2
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.