CID 5017741

61676-62-8

Structural Information

Molecular Formula
C9H19BO3
SMILES
B1(OC(C(O1)(C)C)(C)C)OC(C)C
InChI
InChI=1S/C9H19BO3/c1-7(2)11-10-12-8(3,4)9(5,6)13-10/h7H,1-6H3
InChIKey
MRWWWZLJWNIEEJ-UHFFFAOYSA-N
Compound name
4,4,5,5-tetramethyl-2-propan-2-yloxy-1,3,2-dioxaborolane
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

3
References

8668
Patents

186.14273 Da
Monoisotopic Mass

None
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 187.15001 135.5
[M+Na]+ 209.13195 144.0
[M-H]- 185.13545 140.9
[M+NH4]+ 204.17655 159.1
[M+K]+ 225.10589 146.7
[M+H-H2O]+ 169.13999 133.2
[M+HCOO]- 231.14093 155.5
[M+CH3COO]- 245.15658 183.3
[M+Na-2H]- 207.11740 141.8
[M]+ 186.14218 140.1
[M]- 186.14328 140.1
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

Literature stripe

literature stripe

Patent stripe

patents stripe