CID 136212919

2118959-55-8

Structural Information

Molecular Formula
C36H55OP
SMILES
CC(C)C1=CC(=C(C(=C1)C(C)C)C2=C(C(=CC=C2)OC(C)C)P(C3CCCCC3)C4CCCCC4)C(C)C
InChI
InChI=1S/C36H55OP/c1-24(2)28-22-32(25(3)4)35(33(23-28)26(5)6)31-20-15-21-34(37-27(7)8)36(31)38(29-16-11-9-12-17-29)30-18-13-10-14-19-30/h15,20-27,29-30H,9-14,16-19H2,1-8H3
InChIKey
FDAKNRLXSJBEFL-UHFFFAOYSA-N
Compound name
dicyclohexyl-[2-propan-2-yloxy-6-[2,4,6-tri(propan-2-yl)phenyl]phenyl]phosphane
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

340
Patents

534.39905 Da
Monoisotopic Mass

10.9
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 535.40633 241.2
[M+Na]+ 557.38827 236.4
[M-H]- 533.39177 248.3
[M+NH4]+ 552.43287 245.5
[M+K]+ 573.36221 231.6
[M+H-H2O]+ 517.39631 227.2
[M+HCOO]- 579.39725 251.5
[M+CH3COO]- 593.41290 259.4
[M+Na-2H]- 555.37372 222.8
[M]+ 534.39850 234.6
[M]- 534.39960 234.6
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

Literature stripe

No literature data available for this compound.

Patent stripe

patents stripe