CID 79792

5717-37-3

Structural Information

Molecular Formula
C23H23O2P
SMILES
CCOC(=O)C(=P(C1=CC=CC=C1)(C2=CC=CC=C2)C3=CC=CC=C3)C
InChI
InChI=1S/C23H23O2P/c1-3-25-23(24)19(2)26(20-13-7-4-8-14-20,21-15-9-5-10-16-21)22-17-11-6-12-18-22/h4-18H,3H2,1-2H3
InChIKey
KZENFXVDPUMQOE-UHFFFAOYSA-N
Compound name
ethyl 2-(triphenyl-lambda5-phosphanylidene)propanoate
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

1188
Patents

362.14355 Da
Monoisotopic Mass

4.3
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 363.15083 188.9
[M+Na]+ 385.13277 203.2
[M+NH4]+ 380.17737 196.5
[M+K]+ 401.10671 194.6
[M-H]- 361.13627 194.7
[M+Na-2H]- 383.11822 199.6
[M]+ 362.14300 192.7
[M]- 362.14410 192.7
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

patents stripe