CID 46867875

1217887-12-1

Structural Information

Molecular Formula
C21H33O3P
SMILES
COC1=CC(=C(C(=C1)OC)P(C2CCCCC2)C3CCCCC3)OC
InChI
InChI=1S/C21H33O3P/c1-22-16-14-19(23-2)21(20(15-16)24-3)25(17-10-6-4-7-11-17)18-12-8-5-9-13-18/h14-15,17-18H,4-13H2,1-3H3
InChIKey
ODOMRTFNZDRFHH-UHFFFAOYSA-N
Compound name
dicyclohexyl-(2,4,6-trimethoxyphenyl)phosphane
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

9
Patents

364.21674 Da
Monoisotopic Mass

5.0
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 365.22402 191.8
[M+Na]+ 387.20596 191.8
[M-H]- 363.20946 197.7
[M+NH4]+ 382.25056 203.7
[M+K]+ 403.17990 189.3
[M+H-H2O]+ 347.21400 179.8
[M+HCOO]- 409.21494 210.9
[M+CH3COO]- 423.23059 218.4
[M+Na-2H]- 385.19141 185.0
[M]+ 364.21619 187.6
[M]- 364.21729 187.6
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