CID 118415

33232-87-0

Structural Information

Molecular Formula
C9H12ClO3P
SMILES
CCP(=O)(OC)OC1=CC=C(C=C1)Cl
InChI
InChI=1S/C9H12ClO3P/c1-3-14(11,12-2)13-9-6-4-8(10)5-7-9/h4-7H,3H2,1-2H3
InChIKey
LTMFLDGAGUOMEM-UHFFFAOYSA-N
Compound name
1-chloro-4-[ethyl(methoxy)phosphoryl]oxybenzene
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

234.02126 Da
Monoisotopic Mass

2.3
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 235.02854 146.7
[M+Na]+ 257.01048 159.4
[M+NH4]+ 252.05508 154.5
[M+K]+ 272.98442 153.5
[M-H]- 233.01398 147.4
[M+Na-2H]- 254.99593 152.9
[M]+ 234.02071 148.9
[M]- 234.02181 148.9
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.