CID 55208309

(1e)-1-(4-methoxyphenyl)prop-1-ene-2-sulfonyl chloride

Structural Information

Molecular Formula
C10H11ClO3S
SMILES
C/C(=C\C1=CC=C(C=C1)OC)/S(=O)(=O)Cl
InChI
InChI=1S/C10H11ClO3S/c1-8(15(11,12)13)7-9-3-5-10(14-2)6-4-9/h3-7H,1-2H3/b8-7+
InChIKey
VJDDIMQVDOARJB-BQYQJAHWSA-N
Compound name
(E)-1-(4-methoxyphenyl)prop-1-ene-2-sulfonyl chloride
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

246.01175 Da
Monoisotopic Mass

2.7
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 247.019026 148.2
[M+Na]+ 269.000968 157.7
[M-H]- 245.004474 152.6
[M+NH4]+ 264.045573 167.2
[M+K]+ 284.974908 153.4
[M+H-H2O]+ 229.009010 143.9
[M+HCOO]- 291.009951 161.4
[M+CH3COO]- 305.025601 187.1
[M+Na-2H]- 266.986416 151.4
[M]+ 246.01120142 154.0
[M]- 246.01229858 154.0
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.