CID 67413513

Schembl2450939

Structural Information

Molecular Formula
C11H21BO3
SMILES
B1(OC(C(O1)(C)C)(C)C)C2CC2COC
InChI
InChI=1S/C11H21BO3/c1-10(2)11(3,4)15-12(14-10)9-6-8(9)7-13-5/h8-9H,6-7H2,1-5H3
InChIKey
NCMWGPGSAJAAJY-UHFFFAOYSA-N
Compound name
2-[2-(methoxymethyl)cyclopropyl]-4,4,5,5-tetramethyl-1,3,2-dioxaborolane
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

1
Patents

212.15837 Da
Monoisotopic Mass

None
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 213.16565 142.5
[M+Na]+ 235.14759 152.7
[M-H]- 211.15109 151.9
[M+NH4]+ 230.19219 160.2
[M+K]+ 251.12153 154.7
[M+H-H2O]+ 195.15563 139.3
[M+HCOO]- 257.15657 161.7
[M+CH3COO]- 271.17222 191.0
[M+Na-2H]- 233.13304 148.5
[M]+ 212.15782 150.2
[M]- 212.15892 150.2
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