CID 58824198

(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)methanamine

Structural Information

Molecular Formula
C7H16BNO2
SMILES
B1(OC(C(O1)(C)C)(C)C)CN
InChI
InChI=1S/C7H16BNO2/c1-6(2)7(3,4)11-8(5-9)10-6/h5,9H2,1-4H3
InChIKey
KUPPDIFJIGRZOW-UHFFFAOYSA-N
Compound name
(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)methanamine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

44
Patents

157.12741 Da
Monoisotopic Mass

None
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 158.13469 129.1
[M+Na]+ 180.11663 137.7
[M-H]- 156.12013 134.0
[M+NH4]+ 175.16123 153.2
[M+K]+ 196.09057 139.4
[M+H-H2O]+ 140.12467 126.4
[M+HCOO]- 202.12561 150.7
[M+CH3COO]- 216.14126 178.4
[M+Na-2H]- 178.10208 136.6
[M]+ 157.12686 130.2
[M]- 157.12796 130.2
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