CID 71303784

1346808-41-0

Structural Information

Molecular Formula
C10H16BNO3
SMILES
B1(OC(C(O1)(C)C)(C)C)C2=C(ON=C2)C
InChI
InChI=1S/C10H16BNO3/c1-7-8(6-12-13-7)11-14-9(2,3)10(4,5)15-11/h6H,1-5H3
InChIKey
VWYZENWRLMNXDO-UHFFFAOYSA-N
Compound name
5-methyl-4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)-1,2-oxazole
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

79
Patents

209.12233 Da
Monoisotopic Mass

None
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 210.129606 137.8
[M+Na]+ 232.111548 148.3
[M-H]- 208.115054 146.2
[M+NH4]+ 227.156153 159.5
[M+K]+ 248.085488 150.7
[M+H-H2O]+ 192.119590 134.7
[M+HCOO]- 254.120531 158.5
[M+CH3COO]- 268.136181 185.4
[M+Na-2H]- 230.096996 144.2
[M]+ 209.12178142 143.2
[M]- 209.12287858 143.2
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

patents stripe