CID 9589172

Brn 3629859

Structural Information

Molecular Formula
C23H20Br2N2O
SMILES
C\1C(NC(C(/C1=N/O)C2=CC=CC=C2)C3=CC=C(C=C3)Br)C4=CC=C(C=C4)Br
InChI
InChI=1S/C23H20Br2N2O/c24-18-10-6-15(7-11-18)20-14-21(27-28)22(16-4-2-1-3-5-16)23(26-20)17-8-12-19(25)13-9-17/h1-13,20,22-23,26,28H,14H2/b27-21+
InChIKey
XCCXAQPCIZPNDX-SZXQPVLSSA-N
Compound name
(NE)-N-[2,6-bis(4-bromophenyl)-3-phenylpiperidin-4-ylidene]hydroxylamine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

497.99423 Da
Monoisotopic Mass

5.6
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 499.00151 190.5
[M+Na]+ 520.98345 187.2
[M+NH4]+ 516.02805 192.3
[M+K]+ 536.95739 190.9
[M-H]- 496.98695 194.9
[M+Na-2H]- 518.96890 193.6
[M]+ 497.99368 190.4
[M]- 497.99478 190.4
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.