CID 13624179

Bis(2,4,6-trimethylphenyl)phosphorus chloride

Structural Information

Molecular Formula
C18H22ClP
SMILES
CC1=CC(=C(C(=C1)C)P(C2=C(C=C(C=C2C)C)C)Cl)C
InChI
InChI=1S/C18H22ClP/c1-11-7-13(3)17(14(4)8-11)20(19)18-15(5)9-12(2)10-16(18)6/h7-10H,1-6H3
InChIKey
AZIJQQZQDFCANM-UHFFFAOYSA-N
Compound name
chloro-bis(2,4,6-trimethylphenyl)phosphane
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

37
Patents

304.11478 Da
Monoisotopic Mass

6.0
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 305.12206 170.5
[M+Na]+ 327.10400 181.2
[M-H]- 303.10750 177.1
[M+NH4]+ 322.14860 188.5
[M+K]+ 343.07794 175.1
[M+H-H2O]+ 287.11204 162.4
[M+HCOO]- 349.11298 193.1
[M+CH3COO]- 363.12863 212.5
[M+Na-2H]- 325.08945 166.6
[M]+ 304.11423 176.4
[M]- 304.11533 176.4
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