CID 53431072

212713-08-1

Structural Information

Molecular Formula
C30H46ClO2P
SMILES
CC(C)(C)C1=CC(=CC(=C1OC)C(C)(C)C)P(C2=CC(=C(C(=C2)C(C)(C)C)OC)C(C)(C)C)Cl
InChI
InChI=1S/C30H46ClO2P/c1-27(2,3)21-15-19(16-22(25(21)32-13)28(4,5)6)34(31)20-17-23(29(7,8)9)26(33-14)24(18-20)30(10,11)12/h15-18H,1-14H3
InChIKey
VOGHMZHRQUWLRE-UHFFFAOYSA-N
Compound name
chloro-bis(3,5-ditert-butyl-4-methoxyphenyl)phosphane
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

59
Patents

504.2924 Da
Monoisotopic Mass

10.5
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 505.29968 227.2
[M+Na]+ 527.28162 233.9
[M-H]- 503.28512 233.3
[M+NH4]+ 522.32622 237.5
[M+K]+ 543.25556 229.7
[M+H-H2O]+ 487.28966 218.6
[M+HCOO]- 549.29060 239.8
[M+CH3COO]- 563.30625 251.0
[M+Na-2H]- 525.26707 223.4
[M]+ 504.29185 237.6
[M]- 504.29295 237.6
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