CID 3643263

(5-dimethylamino-2-methyl-oxazol-4-yl)-triphenyl-phosphonium, perchlorate

Structural Information

Molecular Formula
C24H24N2OP
SMILES
CC1=NC(=C(O1)N(C)C)[P+](C2=CC=CC=C2)(C3=CC=CC=C3)C4=CC=CC=C4
InChI
InChI=1S/C24H24N2OP/c1-19-25-23(24(27-19)26(2)3)28(20-13-7-4-8-14-20,21-15-9-5-10-16-21)22-17-11-6-12-18-22/h4-18H,1-3H3/q+1
InChIKey
DOWZZTKAUDZGPU-UHFFFAOYSA-N
Compound name
[5-(dimethylamino)-2-methyl-1,3-oxazol-4-yl]-triphenylphosphanium
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

387.16263 Da
Monoisotopic Mass

5.8
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 388.16991 200.1
[M+Na]+ 410.15185 204.6
[M-H]- 386.15535 212.1
[M+NH4]+ 405.19645 209.9
[M+K]+ 426.12579 195.6
[M+H-H2O]+ 370.15989 189.3
[M+HCOO]- 432.16083 226.1
[M+CH3COO]- 446.17648 219.4
[M+Na-2H]- 408.13730 202.3
[M]+ 387.16208 200.2
[M]- 387.16318 200.2
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.