Ethyl 6,6-dimethyl-4-oxo-3-tetrahydro-1H-pyrrol-1-yl-4,5,6,7-tetrahydrobenzo[c]thiophene-1-carboxylate

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Systematic / IUPAC Name: Ethyl 6,6-dimethyl-4-oxo-3-(1-pyrrolidinyl)-4,5,6,7-tetrahydro-2-benzothiophene-1-carboxylate

ID: Reference4092

Other Names: Benzo[c]thiophene-1-carboxylic acid, 4,5,6,7-tetrahydro-6,6-dimethyl-4-oxo-3-(1-pyrrolidinyl)-, ethyl ester

Formula: C17H23NO3S

Spectral Data

Ethyl 6,6-dimethyl-4-oxo-3-tetrahydro-1H-pyrrol-1-yl-4,5,6,7-tetrahydrobenzo[c]thiophene-1-carboxylate 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 1
No. of Spectra 117
Tandem Spectra MS1, MS2
Ionization Methods ESI
Analyzers FT
Last Modification 3/8/2016 7:26:58 AM
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Identificators

InChI InChI=1S/C17H23NO3S/c1-4-21-16(20)14-11-9-17(2,3)10-12(19)13(11)15(22-14)18-7-5-6-8-18/h4-10H2,1-3H3
InChI Key ZAWMYGASKXPMDK-UHFFFAOYSA-N
Canonical SMILES CCOC(=O)C1=C2CC(CC(=O)C2=C(S1)N3CCCC3)(C)C
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Other Names Benzo[c]thiophene-1-carboxylic acid, 4,5,6,7-tetrahydro-6,6-dimethyl-4-oxo-3-(1-pyrrolidinyl)-, ethyl ester

In Other Databases

PubChem 2820734
ChemSpider 2098963