CID 4061676

121561-25-9

Structural Information

Molecular Formula
C24H27NOP
SMILES
CC(C)(C)C(=O)NC[P+](C1=CC=CC=C1)(C2=CC=CC=C2)C3=CC=CC=C3
InChI
InChI=1S/C24H26NOP/c1-24(2,3)23(26)25-19-27(20-13-7-4-8-14-20,21-15-9-5-10-16-21)22-17-11-6-12-18-22/h4-18H,19H2,1-3H3/p+1
InChIKey
WVCBJRFHIFETEQ-UHFFFAOYSA-O
Compound name
(2,2-dimethylpropanoylamino)methyl-triphenylphosphanium
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

6
Patents

376.183 Da
Monoisotopic Mass

5.4
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 377.19028 192.9
[M+Na]+ 399.17222 208.1
[M+NH4]+ 394.21682 201.8
[M+K]+ 415.14616 200.4
[M-H]- 375.17572 200.9
[M+Na-2H]- 397.15767 204.9
[M]+ 376.18245 197.9
[M]- 376.18355 197.9
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

patents stripe