CID 256127

35000-38-5

Structural Information

Molecular Formula

C₂₄H₂₅O₂P

SMILES

CC(C)(C)OC(=O)C=P(C1=CC=CC=C1)(C2=CC=CC=C2)C3=CC=CC=C3

InChI

InChI=1S/C24H25O2P/c1-24(2,3)26-23(25)19-27(20-13-7-4-8-14-20,21-15-9-5-10-16-21)22-17-11-6-12-18-22/h4-19H,1-3H3

InChIKey

ZWZUFQPXYVYAFO-UHFFFAOYSA-N

Compound name

tert-butyl 2-(triphenyl-lambda5-phosphanylidene)acetate

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 1
References: 1346
Patents: 376.1592 Da
Monoisotopic Mass: 5.0
XlogP (predicted)

Profile

Predicted Collision Cross Section

m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Å²) per adduct calculated using CCSbase.
Adduct	m/z	Predicted CCS (Å²)
[M+H]+	377.16648	193.3
[M+Na]+	399.14842	207.4
[M+NH4]+	394.19302	200.7
[M+K]+	415.12236	199.1
[M-H]-	375.15192	198.7
[M+Na-2H]-	397.13387	204.1
[M]+	376.15865	197.1
[M]-	376.15975	197.1

Literature stripe

literature stripe

Patent stripe

patents stripe