CID 72681964

1071494-86-4

Structural Information

Molecular Formula
C16H30BNO4
SMILES
B1(OC(C(O1)(C)C)(C)C)CC2CCCN2C(=O)OC(C)(C)C
InChI
InChI=1S/C16H30BNO4/c1-14(2,3)20-13(19)18-10-8-9-12(18)11-17-21-15(4,5)16(6,7)22-17/h12H,8-11H2,1-7H3
InChIKey
YSQASZQHGRXRSL-UHFFFAOYSA-N
Compound name
tert-butyl 2-[(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)methyl]pyrrolidine-1-carboxylate
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

311.22678 Da
Monoisotopic Mass

None
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 312.23406 169.5
[M+Na]+ 334.21600 175.7
[M-H]- 310.21950 175.9
[M+NH4]+ 329.26060 188.4
[M+K]+ 350.18994 177.3
[M+H-H2O]+ 294.22404 166.6
[M+HCOO]- 356.22498 184.1
[M+CH3COO]- 370.24063 204.3
[M+Na-2H]- 332.20145 170.9
[M]+ 311.22623 173.0
[M]- 311.22733 173.0
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.