CID 3073558

149990-86-3

Structural Information

Molecular Formula
C21H19N2O2P
SMILES
C1=CC=C(C=C1)P(=CC(=O)C(=O)NN)(C2=CC=CC=C2)C3=CC=CC=C3
InChI
InChI=1S/C21H19N2O2P/c22-23-21(25)20(24)16-26(17-10-4-1-5-11-17,18-12-6-2-7-13-18)19-14-8-3-9-15-19/h1-16H,22H2,(H,23,25)
InChIKey
PTYVROLATVVEJQ-UHFFFAOYSA-N
Compound name
2-oxo-3-(triphenyl-lambda5-phosphanylidene)propanehydrazide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

362.1184 Da
Monoisotopic Mass

3.1
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 363.12568 187.1
[M+Na]+ 385.10762 189.7
[M-H]- 361.11112 193.9
[M+NH4]+ 380.15222 197.5
[M+K]+ 401.08156 184.4
[M+H-H2O]+ 345.11566 175.0
[M+HCOO]- 407.11660 213.8
[M+CH3COO]- 421.13225 217.7
[M+Na-2H]- 383.09307 187.9
[M]+ 362.11785 182.9
[M]- 362.11895 182.9
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.