CID 10886407

17567-17-8

Structural Information

Molecular Formula
C15H21BN6
SMILES
[B-](N1C(=CC(=N1)C)C)(N2C(=CC(=N2)C)C)N3C(=CC(=N3)C)C
InChI
InChI=1S/C15H21BN6/c1-10-7-13(4)20(17-10)16(21-14(5)8-11(2)18-21)22-15(6)9-12(3)19-22/h7-9H,1-6H3/q-1
InChIKey
PHLSBTVKHYMXAW-UHFFFAOYSA-N
Compound name
None
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

296.19208 Da
Monoisotopic Mass

None
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 297.19936 168.8
[M+Na]+ 319.18130 181.9
[M+NH4]+ 314.22590 173.7
[M+K]+ 335.15524 183.3
[M-H]- 295.18480 169.9
[M+Na-2H]- 317.16675 174.2
[M]+ 296.19153 170.5
[M]- 296.19263 170.5
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.