CID 56641709

1262046-34-3

Structural Information

Molecular Formula
C31H49OP
SMILES
CC1=C(C(=C(C=C1)OC)P(C(C)(C)C)C(C)(C)C)C2=C(C=C(C=C2C(C)C)C(C)C)C(C)C
InChI
InChI=1S/C31H49OP/c1-19(2)23-17-24(20(3)4)28(25(18-23)21(5)6)27-22(7)15-16-26(32-14)29(27)33(30(8,9)10)31(11,12)13/h15-21H,1-14H3
InChIKey
CVLLAKCGAFNZHJ-UHFFFAOYSA-N
Compound name
ditert-butyl-[6-methoxy-3-methyl-2-[2,4,6-tri(propan-2-yl)phenyl]phenyl]phosphane
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

1127
Patents

468.3521 Da
Monoisotopic Mass

8.8
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 469.35938 221.7
[M+Na]+ 491.34132 225.6
[M-H]- 467.34482 226.9
[M+NH4]+ 486.38592 232.0
[M+K]+ 507.31526 222.5
[M+H-H2O]+ 451.34936 212.2
[M+HCOO]- 513.35030 238.4
[M+CH3COO]- 527.36595 251.3
[M+Na-2H]- 489.32677 211.0
[M]+ 468.35155 228.4
[M]- 468.35265 228.4
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

No patent data available for this compound.