CID 19894483

3-(dimethylphosphoryl)prop-1-ene

Structural Information

Molecular Formula
C5H11OP
SMILES
CP(=O)(C)CC=C
InChI
InChI=1S/C5H11OP/c1-4-5-7(2,3)6/h4H,1,5H2,2-3H3
InChIKey
LNPTVRAXAJIFRK-UHFFFAOYSA-N
Compound name
3-dimethylphosphorylprop-1-ene
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

247
Patents

118.05475 Da
Monoisotopic Mass

0.0
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 119.062026 125.8
[M+Na]+ 141.043968 134.2
[M-H]- 117.047474 125.4
[M+NH4]+ 136.088573 149.3
[M+K]+ 157.017908 133.7
[M+H-H2O]+ 101.052010 120.2
[M+HCOO]- 163.052951 154.2
[M+CH3COO]- 177.068601 171.5
[M+Na-2H]- 139.029416 130.4
[M]+ 118.05420142 128.2
[M]- 118.05529858 128.2
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

patents stripe