CID 11110495

Di-1-adamantylchlorophosphine

Structural Information

Molecular Formula
C20H30ClP
SMILES
C1C2CC3CC1CC(C2)(C3)P(C45CC6CC(C4)CC(C6)C5)Cl
InChI
InChI=1S/C20H30ClP/c21-22(19-7-13-1-14(8-19)3-15(2-13)9-19)20-10-16-4-17(11-20)6-18(5-16)12-20/h13-18H,1-12H2
InChIKey
BVOJCPQWSXCCKU-UHFFFAOYSA-N
Compound name
bis(1-adamantyl)-chlorophosphane
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

120
Patents

336.17737 Da
Monoisotopic Mass

6.1
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 337.18465 175.6
[M+Na]+ 359.16659 168.7
[M-H]- 335.17009 164.0
[M+NH4]+ 354.21119 198.0
[M+K]+ 375.14053 161.2
[M+H-H2O]+ 319.17463 158.9
[M+HCOO]- 381.17557 164.4
[M+CH3COO]- 395.19122 175.4
[M+Na-2H]- 357.15204 177.2
[M]+ 336.17682 171.0
[M]- 336.17792 171.0
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