CID 165656222

En300-37327883

Structural Information

Molecular Formula
C11H21BO3
SMILES
B1(OC(C(O1)(C)C)(C)C)/C=C(/C)\COC
InChI
InChI=1S/C11H21BO3/c1-9(8-13-6)7-12-14-10(2,3)11(4,5)15-12/h7H,8H2,1-6H3/b9-7-
InChIKey
NMMLJPPPMPZHRH-CLFYSBASSA-N
Compound name
2-[(Z)-3-methoxy-2-methylprop-1-enyl]-4,4,5,5-tetramethyl-1,3,2-dioxaborolane
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

212.15837 Da
Monoisotopic Mass

None
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 213.165646 143.6
[M+Na]+ 235.147588 151.6
[M-H]- 211.151094 148.7
[M+NH4]+ 230.192193 166.2
[M+K]+ 251.121528 153.3
[M+H-H2O]+ 195.155630 141.1
[M+HCOO]- 257.156571 163.1
[M+CH3COO]- 271.172221 187.7
[M+Na-2H]- 233.133036 148.9
[M]+ 212.15782142 148.2
[M]- 212.15891858 148.2
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.