CID 118810254

80890-26-2

Structural Information

Molecular Formula
C35H30N2P
SMILES
C1=CC=C(C=C1)/C=C/C=N/N/C(=C\[P+](C2=CC=CC=C2)(C3=CC=CC=C3)C4=CC=CC=C4)/C5=CC=CC=C5
InChI
InChI=1S/C35H30N2P/c1-6-17-30(18-7-1)19-16-28-36-37-35(31-20-8-2-9-21-31)29-38(32-22-10-3-11-23-32,33-24-12-4-13-25-33)34-26-14-5-15-27-34/h1-29,37H/q+1/b19-16+,35-29-,36-28+
InChIKey
ZSLUOFHIOBFJSU-LURCJGAKSA-N
Compound name
triphenyl-[(Z)-2-phenyl-2-[(2E)-2-[(E)-3-phenylprop-2-enylidene]hydrazinyl]ethenyl]phosphanium
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

509.21466 Da
Monoisotopic Mass

8.4
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 510.22194 234.5
[M+Na]+ 532.20388 233.2
[M-H]- 508.20738 246.3
[M+NH4]+ 527.24848 237.6
[M+K]+ 548.17782 218.3
[M+H-H2O]+ 492.21192 220.1
[M+HCOO]- 554.21286 259.2
[M+CH3COO]- 568.22851 240.8
[M+Na-2H]- 530.18933 236.3
[M]+ 509.21411 227.6
[M]- 509.21521 227.6
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.