CID 3253995

1519-41-1

Structural Information

Molecular Formula
C20H36P
SMILES
CCCC[P+](CCCC)(CCCC)CC1=CC=C(C=C1)C
InChI
InChI=1S/C20H36P/c1-5-8-15-21(16-9-6-2,17-10-7-3)18-20-13-11-19(4)12-14-20/h11-14H,5-10,15-18H2,1-4H3/q+1
InChIKey
OSHXYOPATMTISG-UHFFFAOYSA-N
Compound name
tributyl-[(4-methylphenyl)methyl]phosphanium
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

7
Patents

307.25546 Da
Monoisotopic Mass

5.6
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 308.26274 189.1
[M+Na]+ 330.24468 192.9
[M-H]- 306.24818 190.4
[M+NH4]+ 325.28928 204.9
[M+K]+ 346.21862 183.1
[M+H-H2O]+ 290.25272 182.7
[M+HCOO]- 352.25366 213.2
[M+CH3COO]- 366.26931 206.9
[M+Na-2H]- 328.23013 189.7
[M]+ 307.25491 193.3
[M]- 307.25601 193.3
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