CID 9588382

(4-ethoxyphenylthio)acetamidoxime hydrochloride

Structural Information

Molecular Formula
C10H14N2O2S
SMILES
CCOC1=CC=C(C=C1)SC/C(=N\O)/N
InChI
InChI=1S/C10H14N2O2S/c1-2-14-8-3-5-9(6-4-8)15-7-10(11)12-13/h3-6,13H,2,7H2,1H3,(H2,11,12)
InChIKey
WEJJXLFMUHDPRU-UHFFFAOYSA-N
Compound name
2-(4-ethoxyphenyl)sulfanyl-N'-hydroxyethanimidamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

226.0776 Da
Monoisotopic Mass

2.0
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 227.084876 148.6
[M+Na]+ 249.066818 154.7
[M-H]- 225.070324 151.6
[M+NH4]+ 244.111423 166.4
[M+K]+ 265.040758 151.7
[M+H-H2O]+ 209.074860 141.6
[M+HCOO]- 271.075801 168.3
[M+CH3COO]- 285.091451 191.8
[M+Na-2H]- 247.052266 151.0
[M]+ 226.07705142 150.2
[M]- 226.07814858 150.2
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

No patent data available for this compound.