CID 206259

Phosphine oxide, diphenyl(3-methylbutyl)-

Structural Information

Molecular Formula
C17H21OP
SMILES
CC(C)CCP(=O)(C1=CC=CC=C1)C2=CC=CC=C2
InChI
InChI=1S/C17H21OP/c1-15(2)13-14-19(18,16-9-5-3-6-10-16)17-11-7-4-8-12-17/h3-12,15H,13-14H2,1-2H3
InChIKey
BUOOWRGRHRCBCW-UHFFFAOYSA-N
Compound name
[3-methylbutyl(phenyl)phosphoryl]benzene
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

2
Patents

272.133 Da
Monoisotopic Mass

4.2
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 273.14028 168.2
[M+Na]+ 295.12222 173.3
[M-H]- 271.12572 173.0
[M+NH4]+ 290.16682 184.5
[M+K]+ 311.09616 169.4
[M+H-H2O]+ 255.13026 158.3
[M+HCOO]- 317.13120 194.3
[M+CH3COO]- 331.14685 200.5
[M+Na-2H]- 293.10767 169.7
[M]+ 272.13245 169.1
[M]- 272.13355 169.1
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