CID 329848

Nsc624852

Structural Information

Molecular Formula
C23H19N2P
SMILES
C1=CC=C(C=C1)P(=NN=C2C=CC=C2)(C3=CC=CC=C3)C4=CC=CC=C4
InChI
InChI=1S/C23H19N2P/c1-4-14-21(15-5-1)26(22-16-6-2-7-17-22,23-18-8-3-9-19-23)25-24-20-12-10-11-13-20/h1-19H
InChIKey
HJAJSXPYCWUMII-UHFFFAOYSA-N
Compound name
N-[(triphenyl-lambda5-phosphanylidene)amino]cyclopenta-2,4-dien-1-imine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

354.12857 Da
Monoisotopic Mass

6.0
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 355.13585 184.5
[M+Na]+ 377.11779 188.8
[M-H]- 353.12129 197.5
[M+NH4]+ 372.16239 198.5
[M+K]+ 393.09173 182.8
[M+H-H2O]+ 337.12583 171.3
[M+HCOO]- 399.12677 217.2
[M+CH3COO]- 413.14242 195.3
[M+Na-2H]- 375.10324 187.5
[M]+ 354.12802 182.7
[M]- 354.12912 182.7
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

Literature stripe

literature stripe

Patent stripe

No patent data available for this compound.