CID 137347011

2851875-15-3

Structural Information

Molecular Formula
C14H26BNO2
SMILES
B1(OC(C(O1)(C)C)(C)C)C2=CCC(CC2)N(C)C
InChI
InChI=1S/C14H26BNO2/c1-13(2)14(3,4)18-15(17-13)11-7-9-12(10-8-11)16(5)6/h7,12H,8-10H2,1-6H3
InChIKey
VTFPQICQYBBNII-UHFFFAOYSA-N
Compound name
N,N-dimethyl-4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)cyclohex-3-en-1-amine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

251.20566 Da
Monoisotopic Mass

None
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 252.21294 158.0
[M+Na]+ 274.19488 168.1
[M+NH4]+ 269.23948 169.2
[M+K]+ 290.16882 161.3
[M-H]- 250.19838 164.6
[M+Na-2H]- 272.18033 164.7
[M]+ 251.20511 161.6
[M]- 251.20621 161.6
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

No patent data available for this compound.