CID 17750202

904326-87-0

Structural Information

Molecular Formula
C13H19BN2O3
SMILES
B1(OC(C(O1)(C)C)(C)C)C2=CN=C(C=C2)NC(=O)C
InChI
InChI=1S/C13H19BN2O3/c1-9(17)16-11-7-6-10(8-15-11)14-18-12(2,3)13(4,5)19-14/h6-8H,1-5H3,(H,15,16,17)
InChIKey
YCWPTBAHVWJMEY-UHFFFAOYSA-N
Compound name
N-[5-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)pyridin-2-yl]acetamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

304
Patents

262.14886 Da
Monoisotopic Mass

None
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 263.15614 157.3
[M+Na]+ 285.13808 168.3
[M+NH4]+ 280.18268 166.8
[M+K]+ 301.11202 162.4
[M-H]- 261.14158 162.2
[M+Na-2H]- 283.12353 164.5
[M]+ 262.14831 160.5
[M]- 262.14941 160.5
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