CID 11157260

2,6-bis(di-tert-butylphosphinomethyl)pyridine

Structural Information

Molecular Formula
C23H43NP2
SMILES
CC(C)(C)P(CC1=NC(=CC=C1)CP(C(C)(C)C)C(C)(C)C)C(C)(C)C
InChI
InChI=1S/C23H43NP2/c1-20(2,3)25(21(4,5)6)16-18-14-13-15-19(24-18)17-26(22(7,8)9)23(10,11)12/h13-15H,16-17H2,1-12H3
InChIKey
NJQAVBPPWNSBBC-UHFFFAOYSA-N
Compound name
ditert-butyl-[[6-(ditert-butylphosphanylmethyl)-2-pyridinyl]methyl]phosphane
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

3
References

202
Patents

395.28708 Da
Monoisotopic Mass

3.9
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 396.29436 215.0
[M+Na]+ 418.27630 217.8
[M-H]- 394.27980 214.2
[M+NH4]+ 413.32090 227.1
[M+K]+ 434.25024 215.5
[M+H-H2O]+ 378.28434 204.1
[M+HCOO]- 440.28528 235.3
[M+CH3COO]- 454.30093 231.9
[M+Na-2H]- 416.26175 210.6
[M]+ 395.28653 219.9
[M]- 395.28763 219.9
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.