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1-[.beta.-(4-oxo-4,5,6,7-tetrahydrobenzo[b]thiophen-5-yl)ethyl]-4-(o-methoxyphenyl)piperazine
SpectraBase Compound ID 7KAb8fCjSNP
InChI InChI=1S/C21H26N2O2S/c1-25-19-5-3-2-4-18(19)23-13-11-22(12-14-23)10-8-16-6-7-20-17(21(16)24)9-15-26-20/h2-5,9,15-16H,6-8,10-14H2,1H3
InChIKey HIFLACAUPGVDAM-UHFFFAOYSA-N
Mol Weight 370.51 g/mol
Molecular Formula C21H26N2O2S
Exact Mass 370.171499 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 9nWPPjezShz
Name 1-[.beta.-(4-oxo-4,5,6,7-tetrahydrobenzo[b]thiophen-5-yl)ethyl]-4-(o-methoxyphenyl)piperazine
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Formula C21H26N2O2S
InChI InChI=1S/C21H26N2O2S/c1-25-19-5-3-2-4-18(19)23-13-11-22(12-14-23)10-8-16-6-7-20-17(21(16)24)9-15-26-20/h2-5,9,15-16H,6-8,10-14H2,1H3
InChIKey HIFLACAUPGVDAM-UHFFFAOYSA-N
Instrument Name Micromass QMD 1000
Ionization Type EI
Literature Reference DOI 10.1002_(SICI)1097-0231(19980630)12_12_793
Molecular Weight 370.511 g/mol
SMILES c12C(C(CCc2scc1)CCN1CCN(CC1)c1ccccc1OC)=O
SPLASH splash10-02t9-0891000000-7921cf31ed0501fa779d
Source of Spectrum RCM-12-795-5
Wiley ID 1836141