CID 3048370

63904-90-5

Structural Information

Molecular Formula
C13H22P
SMILES
CC[P+](CC)(CC)C1=CC=C(C=C1)C
InChI
InChI=1S/C13H22P/c1-5-14(6-2,7-3)13-10-8-12(4)9-11-13/h8-11H,5-7H2,1-4H3/q+1
InChIKey
RTWMBNIYJYTZSG-UHFFFAOYSA-N
Compound name
triethyl-(4-methylphenyl)phosphanium
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

1
Patents

209.14592 Da
Monoisotopic Mass

3.0
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 210.15320 154.7
[M+Na]+ 232.13514 161.5
[M-H]- 208.13864 157.4
[M+NH4]+ 227.17974 174.5
[M+K]+ 248.10908 153.5
[M+H-H2O]+ 192.14318 149.8
[M+HCOO]- 254.14412 181.2
[M+CH3COO]- 268.15977 185.6
[M+Na-2H]- 230.12059 159.3
[M]+ 209.14537 156.4
[M]- 209.14647 156.4
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.