CID 67475893

Di-tert-butyl({2',6'-dimethoxy-[1,1'-biphenyl]-2-yl})phosphane

Structural Information

Molecular Formula
C22H31O2P
SMILES
CC(C)(C)P(C1=CC=CC=C1C2=C(C=CC=C2OC)OC)C(C)(C)C
InChI
InChI=1S/C22H31O2P/c1-21(2,3)25(22(4,5)6)19-15-10-9-12-16(19)20-17(23-7)13-11-14-18(20)24-8/h9-15H,1-8H3
InChIKey
JJPUFWFLYXQTEU-UHFFFAOYSA-N
Compound name
ditert-butyl-[2-(2,6-dimethoxyphenyl)phenyl]phosphane
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

32
Patents

358.20618 Da
Monoisotopic Mass

5.0
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 359.21346 193.4
[M+Na]+ 381.19540 199.3
[M-H]- 357.19890 198.9
[M+NH4]+ 376.24000 207.4
[M+K]+ 397.16934 196.5
[M+H-H2O]+ 341.20344 183.6
[M+HCOO]- 403.20438 216.3
[M+CH3COO]- 417.22003 220.9
[M+Na-2H]- 379.18085 191.9
[M]+ 358.20563 198.8
[M]- 358.20673 198.8
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