CID 46848051

Bis(1-adamantyl)-(2-morpholin-4-ylphenyl)phosphane;chlorogold

Structural Information

Molecular Formula
C30H42NOP
SMILES
C1COCCN1C2=CC=CC=C2P(C34CC5CC(C3)CC(C5)C4)C67CC8CC(C6)CC(C8)C7
InChI
InChI=1S/C30H42NOP/c1-2-4-28(27(3-1)31-5-7-32-8-6-31)33(29-15-21-9-22(16-29)11-23(10-21)17-29)30-18-24-12-25(19-30)14-26(13-24)20-30/h1-4,21-26H,5-20H2
InChIKey
CCBRRSUORFMQCZ-UHFFFAOYSA-N
Compound name
bis(1-adamantyl)-(2-morpholin-4-ylphenyl)phosphane
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

1
References

497
Patents

463.3004 Da
Monoisotopic Mass

6.6
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 464.30768 224.1
[M+Na]+ 486.28962 231.5
[M+NH4]+ 481.33422 238.6
[M+K]+ 502.26356 217.7
[M-H]- 462.29312 225.5
[M+Na-2H]- 484.27507 214.3
[M]+ 463.29985 225.9
[M]- 463.30095 225.9
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