CID 10907360

55700-44-2

Structural Information

Molecular Formula
C21H23NP
SMILES
C[C@@H]([C]1C=CC=C1P(C2=CC=CC=C2)C3=CC=CC=C3)N(C)C
InChI
InChI=1S/C21H23NP/c1-17(22(2)3)20-15-10-16-21(20)23(18-11-6-4-7-12-18)19-13-8-5-9-14-19/h4-17H,1-3H3/t17-/m0/s1
InChIKey
VJYQTMNDWOEPIV-KRWDZBQOSA-N
Compound name
None
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

320.1568 Da
Monoisotopic Mass

4.5
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 321.16408 181.6
[M+Na]+ 343.14602 185.0
[M-H]- 319.14952 190.7
[M+NH4]+ 338.19062 197.5
[M+K]+ 359.11996 181.3
[M+H-H2O]+ 303.15406 170.1
[M+HCOO]- 365.15500 210.0
[M+CH3COO]- 379.17065 216.6
[M+Na-2H]- 341.13147 177.5
[M]+ 320.15625 181.7
[M]- 320.15735 181.7
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.