CID 132327953

2246802-17-3

Structural Information

Molecular Formula
C15H26BNO4
SMILES
B1(OC(C(O1)(C)C)(C)C)C=C2CN(C2)C(=O)OC(C)(C)C
InChI
InChI=1S/C15H26BNO4/c1-13(2,3)19-12(18)17-9-11(10-17)8-16-20-14(4,5)15(6,7)21-16/h8H,9-10H2,1-7H3
InChIKey
GWNZSYWYUFJXLE-UHFFFAOYSA-N
Compound name
tert-butyl 3-[(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)methylidene]azetidine-1-carboxylate
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

22
Patents

295.1955 Da
Monoisotopic Mass

None
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 296.20278 163.2
[M+Na]+ 318.18472 168.6
[M-H]- 294.18822 169.8
[M+NH4]+ 313.22932 174.6
[M+K]+ 334.15866 172.8
[M+H-H2O]+ 278.19276 155.7
[M+HCOO]- 340.19370 177.2
[M+CH3COO]- 354.20935 204.2
[M+Na-2H]- 316.17017 166.2
[M]+ 295.19495 175.6
[M]- 295.19605 175.6
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