CID 45047990

(2-(benzoylhydrazinylidene)propyl)triphenylphosphonium bromide

Structural Information

Molecular Formula
C28H26N2OP
SMILES
C/C(=N\NC(=O)C1=CC=CC=C1)/C[P+](C2=CC=CC=C2)(C3=CC=CC=C3)C4=CC=CC=C4
InChI
InChI=1S/C28H25N2OP/c1-23(29-30-28(31)24-14-6-2-7-15-24)22-32(25-16-8-3-9-17-25,26-18-10-4-11-19-26)27-20-12-5-13-21-27/h2-21H,22H2,1H3/p+1/b29-23+
InChIKey
URUBKMSOSXNCIF-BYNJWEBRSA-O
Compound name
[(2E)-2-(benzoylhydrazinylidene)propyl]-triphenylphosphanium
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

437.17828 Da
Monoisotopic Mass

5.8
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 438.18556 212.7
[M+Na]+ 460.16750 212.9
[M-H]- 436.17100 223.4
[M+NH4]+ 455.21210 219.8
[M+K]+ 476.14144 201.5
[M+H-H2O]+ 420.17554 200.7
[M+HCOO]- 482.17648 238.8
[M+CH3COO]- 496.19213 228.8
[M+Na-2H]- 458.15295 215.6
[M]+ 437.17773 208.5
[M]- 437.17883 208.5
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.