CID 7538

Tris(1-aminopropan-2-yl) borate

Structural Information

Molecular Formula
C9H24BN3O3
SMILES
B(OC(C)CN)(OC(C)CN)OC(C)CN
InChI
InChI=1S/C9H24BN3O3/c1-7(4-11)14-10(15-8(2)5-12)16-9(3)6-13/h7-9H,4-6,11-13H2,1-3H3
InChIKey
SMIBBGLDGBPYJI-UHFFFAOYSA-N
Compound name
tris(1-aminopropan-2-yl) borate
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

233.19107 Da
Monoisotopic Mass

None
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 234.198346 158.0
[M+Na]+ 256.180288 160.0
[M-H]- 232.183794 156.0
[M+NH4]+ 251.224893 173.8
[M+K]+ 272.154228 161.4
[M+H-H2O]+ 216.188330 150.9
[M+HCOO]- 278.189271 178.4
[M+CH3COO]- 292.204921 201.5
[M+Na-2H]- 254.165736 155.4
[M]+ 233.19052142 156.8
[M]- 233.19161858 156.8
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.