CID 134868364

[(2z)-2-(benzenesulfonyl)-3-(dimethylamino)prop-2-en-1-ylidene]dimethylazanium; hexafluoro-lambda5-phosphanuide

Structural Information

Molecular Formula
C13H19N2O2S
SMILES
CN(C)/C=C(/C=[N+](C)C)\S(=O)(=O)C1=CC=CC=C1
InChI
InChI=1S/C13H19N2O2S/c1-14(2)10-13(11-15(3)4)18(16,17)12-8-6-5-7-9-12/h5-11H,1-4H3/q+1
InChIKey
FKMVFLHPCHEAPW-UHFFFAOYSA-N
Compound name
[(Z)-2-(benzenesulfonyl)-3-(dimethylamino)prop-2-enylidene]-dimethylazanium
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

267.11673 Da
Monoisotopic Mass

1.2
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 268.12401 159.2
[M+Na]+ 290.10595 164.5
[M-H]- 266.10945 165.5
[M+NH4]+ 285.15055 176.3
[M+K]+ 306.07989 157.2
[M+H-H2O]+ 250.11399 154.7
[M+HCOO]- 312.11493 178.3
[M+CH3COO]- 326.13058 196.7
[M+Na-2H]- 288.09140 163.8
[M]+ 267.11618 160.8
[M]- 267.11728 160.8
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.