CID 495785

Schembl19410810

Structural Information

Molecular Formula
C23H26BNO
SMILES
B(C1=CC=CC=C1)(C2=CC=CC=C2)OC(C3=CC=CC=C3)C(C)N(C)C
InChI
InChI=1S/C23H26BNO/c1-19(25(2)3)23(20-13-7-4-8-14-20)26-24(21-15-9-5-10-16-21)22-17-11-6-12-18-22/h4-19,23H,1-3H3
InChIKey
MQHUQMWWSRHNEW-UHFFFAOYSA-N
Compound name
1-diphenylboranyloxy-N,N-dimethyl-1-phenylpropan-2-amine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

4
Patents

343.21075 Da
Monoisotopic Mass

None
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 344.21803 185.4
[M+Na]+ 366.19997 187.0
[M-H]- 342.20347 194.7
[M+NH4]+ 361.24457 197.4
[M+K]+ 382.17391 183.7
[M+H-H2O]+ 326.20801 174.9
[M+HCOO]- 388.20895 206.2
[M+CH3COO]- 402.22460 219.9
[M+Na-2H]- 364.18542 186.7
[M]+ 343.21020 185.0
[M]- 343.21130 185.0
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.