N1-(4-Fluorophenyl)-2-[3-(3,4,5-trimethoxyphenyl)propanoyl]hydrazine-1-carbothioamide

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Systematic / IUPAC Name: N-(4-Fluorophenyl)-2-[3-(3,4,5-trimethoxyphenyl)propanoyl]hydrazinecarbothioamide

ID: Reference8444

Other Names: Benzenepropanoic acid, 3,4,5-trimethoxy-, 2-[[(4-fluorophenyl)amino]thioxomethyl]hydrazide;
1-(4-Fluorophenyl)-3-[3-(3,4,5-trimethoxyphenyl)propanoylamino]thiourea

Formula: C19H22FN3O4S

Spectral Data

N1-(4-Fluorophenyl)-2-[3-(3,4,5-trimethoxyphenyl)propanoyl]hydrazine-1-carbothioamide mass spectral data can be found in a separate interface. The data are manually curated and of the highest quality.

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Available MS Data

Used Instruments Q Exactive Orbitrap
No. of Spectral Trees 2
No. of Spectra 220
Tandem Spectra MS1, MS2
Ionization Methods ESI
Analyzers FT
Last Modification 12/11/2018 10:44:15 AM
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Identificators

InChI InChI=1S/C19H22FN3O4S/c1-25-15-10-12(11-16(26-2)18(15)27-3)4-9-17(24)22-23-19(28)21-14-7-5-13(20)6-8-14/h5-8,10-11H,4,9H2,1-3H3,(H,22,24)(H2,21,23,28)
InChI Key OBTHFAHBFZEWSW-UHFFFAOYSA-N
Canonical SMILES COC1=CC(=CC(=C1OC)OC)CCC(=O)NNC(=S)NC2=CC=C(C=C2)F
CAS
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Other Names Benzenepropanoic acid, 3,4,5-trimethoxy-, 2-[[(4-fluorophenyl)amino]thioxomethyl]hydrazide;
1-(4-Fluorophenyl)-3-[3-(3,4,5-trimethoxyphenyl)propanoylamino]thiourea

In Other Databases

ChemSpider 2076223
PubChem 2797417