CID 24229653

910037-15-9

Structural Information

Molecular Formula
C14H21BN2O3
SMILES
B1(OC(C(O1)(C)C)(C)C)C2=CC3=C(N=C2)N(CCO3)C
InChI
InChI=1S/C14H21BN2O3/c1-13(2)14(3,4)20-15(19-13)10-8-11-12(16-9-10)17(5)6-7-18-11/h8-9H,6-7H2,1-5H3
InChIKey
PDTRXHRSCGNYFD-UHFFFAOYSA-N
Compound name
4-methyl-7-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)-2,3-dihydropyrido[3,2-b][1,4]oxazine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

91
Patents

276.16452 Da
Monoisotopic Mass

None
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 277.17180 161.0
[M+Na]+ 299.15374 170.6
[M-H]- 275.15724 168.1
[M+NH4]+ 294.19834 177.8
[M+K]+ 315.12768 171.5
[M+H-H2O]+ 259.16178 154.1
[M+HCOO]- 321.16272 175.0
[M+CH3COO]- 335.17837 173.4
[M+Na-2H]- 297.13919 166.3
[M]+ 276.16397 163.8
[M]- 276.16507 163.8
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