CID 139074319

N,n-bis(diphenylphosphino)-1,2-dimethylpropylamine

Structural Information

Molecular Formula
C29H31NP2
SMILES
C[C@@H](C(C)C)N(P(C1=CC=CC=C1)C2=CC=CC=C2)P(C3=CC=CC=C3)C4=CC=CC=C4
InChI
InChI=1S/C29H31NP2/c1-24(2)25(3)30(31(26-16-8-4-9-17-26)27-18-10-5-11-19-27)32(28-20-12-6-13-21-28)29-22-14-7-15-23-29/h4-25H,1-3H3/t25-/m0/s1
InChIKey
VSFRKLMGBIYIRT-VWLOTQADSA-N
Compound name
(2S)-N,N-bis(diphenylphosphanyl)-3-methylbutan-2-amine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

455.19318 Da
Monoisotopic Mass

8.1
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 456.20046 218.5
[M+Na]+ 478.18240 216.6
[M-H]- 454.18590 227.0
[M+NH4]+ 473.22700 225.5
[M+K]+ 494.15634 212.0
[M+H-H2O]+ 438.19044 201.5
[M+HCOO]- 500.19138 246.1
[M+CH3COO]- 514.20703 243.1
[M+Na-2H]- 476.16785 209.0
[M]+ 455.19263 215.8
[M]- 455.19373 215.8
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

No patent data available for this compound.