CID 165793623

4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)pent-4-en-1-amine hydrochloride

Structural Information

Molecular Formula
C11H22BNO2
SMILES
B1(OC(C(O1)(C)C)(C)C)C(=C)CCCN
InChI
InChI=1S/C11H22BNO2/c1-9(7-6-8-13)12-14-10(2,3)11(4,5)15-12/h1,6-8,13H2,2-5H3
InChIKey
YLSYJSWWBGARTK-UHFFFAOYSA-N
Compound name
4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)pent-4-en-1-amine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

211.17436 Da
Monoisotopic Mass

None
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 212.18164 146.9
[M+Na]+ 234.16358 153.9
[M-H]- 210.16708 151.2
[M+NH4]+ 229.20818 168.7
[M+K]+ 250.13752 154.5
[M+H-H2O]+ 194.17162 143.7
[M+HCOO]- 256.17256 166.4
[M+CH3COO]- 270.18821 190.6
[M+Na-2H]- 232.14903 151.0
[M]+ 211.17381 148.1
[M]- 211.17491 148.1
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.