CID 56949990

1357398-60-7

Structural Information

Molecular Formula
C26H33N2P
SMILES
CN1C2=CC=CC=C2N=C1C3=CC=CC=C3P(C4CCCCC4)C5CCCCC5
InChI
InChI=1S/C26H33N2P/c1-28-24-18-10-9-17-23(24)27-26(28)22-16-8-11-19-25(22)29(20-12-4-2-5-13-20)21-14-6-3-7-15-21/h8-11,16-21H,2-7,12-15H2,1H3
InChIKey
IBOIHFPCQHFOOP-UHFFFAOYSA-N
Compound name
dicyclohexyl-[2-(1-methylbenzimidazol-2-yl)phenyl]phosphane
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

404.23813 Da
Monoisotopic Mass

6.3
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 405.24541 201.7
[M+Na]+ 427.22735 202.6
[M-H]- 403.23085 208.7
[M+NH4]+ 422.27195 211.1
[M+K]+ 443.20129 195.4
[M+H-H2O]+ 387.23539 186.4
[M+HCOO]- 449.23633 218.4
[M+CH3COO]- 463.25198 207.7
[M+Na-2H]- 425.21280 194.1
[M]+ 404.23758 193.1
[M]- 404.23868 193.1
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