CID 22925485

1228182-34-0

Structural Information

Molecular Formula

C₁₅H₂₂F₃P

SMILES

CC(C)(C)P(C1=CC=C(C=C1)C(F)(F)F)C(C)(C)C

InChI

InChI=1S/C15H22F3P/c1-13(2,3)19(14(4,5)6)12-9-7-11(8-10-12)15(16,17)18/h7-10H,1-6H3

InChIKey

ILWCCADVRXVLTN-UHFFFAOYSA-N

Compound name

ditert-butyl-[4-(trifluoromethyl)phenyl]phosphane

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 0
References: 49
Patents: 290.1411 Da
Monoisotopic Mass: 4.3
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]+	291.148376	171.7
[M+Na]+	313.130318	178.5
[M-H]-	289.133824	170.3
[M+NH4]+	308.174923	188.5
[M+K]+	329.104258	175.6
[M+H-H2O]+	273.138360	161.8
[M+HCOO]-	335.139301	190.4
[M+CH3COO]-	349.154951	206.1
[M+Na-2H]-	311.115766	171.7
[M]+	290.14055142	169.5
[M]-	290.14164858	169.5

Literature stripe

No literature data available for this compound.

Patent stripe

patents stripe