CID 5256542

Schembl995680

Structural Information

Molecular Formula
C23H27NP
SMILES
CCN(CC)[P+](CC1=CC=CC=C1)(C2=CC=CC=C2)C3=CC=CC=C3
InChI
InChI=1S/C23H27NP/c1-3-24(4-2)25(22-16-10-6-11-17-22,23-18-12-7-13-19-23)20-21-14-8-5-9-15-21/h5-19H,3-4,20H2,1-2H3/q+1
InChIKey
BPMXVYBQJXDTGH-UHFFFAOYSA-N
Compound name
benzyl-(diethylamino)-diphenylphosphanium
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

279
Patents

348.1881 Da
Monoisotopic Mass

5.5
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 349.19538 193.1
[M+Na]+ 371.17732 195.5
[M-H]- 347.18082 201.5
[M+NH4]+ 366.22192 205.4
[M+K]+ 387.15126 185.2
[M+H-H2O]+ 331.18536 183.1
[M+HCOO]- 393.18630 219.7
[M+CH3COO]- 407.20195 214.0
[M+Na-2H]- 369.16277 196.5
[M]+ 348.18755 192.0
[M]- 348.18865 192.0
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.