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3-Ethoxy-4,5,6,7-tetrahydro-3aH-inden-2-yl N-phenyl(ethaneimido)thioate
SpectraBase Compound ID HPax445gK3d
InChI InChI=1S/C19H23NOS/c1-3-21-18-13-19(17-12-8-7-11-16(17)18)22-14(2)20-15-9-5-4-6-10-15/h4-6,9-10,13,16H,3,7-8,11-12H2,1-2H3/b20-14+/t16-/m1/s1
InChIKey IXFWAHCHVYNAHS-ZGPWBKFBSA-N
Mol Weight 313.46 g/mol
Molecular Formula C19H23NOS
Exact Mass 313.150036 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID IX6YrH9IYvV
Name 3-Ethoxy-4,5,6,7-tetrahydro-3aH-inden-2-yl N-phenyl(ethaneimido)thioate
Comments Less than 3 mono-isotopic peaks
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Formula C19H23NOS
InChI InChI=1S/C19H23NOS/c1-3-21-18-13-19(17-12-8-7-11-16(17)18)22-14(2)20-15-9-5-4-6-10-15/h4-6,9-10,13,16H,3,7-8,11-12H2,1-2H3/b20-14+/t16-/m1/s1
InChIKey IXFWAHCHVYNAHS-ZGPWBKFBSA-N
Molecular Weight 313.459 g/mol
SMILES C=1(C=C(OCC)[C@]2(C1CCCC2)[H])S\C(=N\c1ccccc1)C
SPLASH splash10-014i-0900000000-8282f3b779432a08e8d8
Source of Spectrum K1-2002-367-12
Synonyms (3aR)-3-Ethoxy-4,5,6,7-tetrahydro-3aH-inden-1-yl (1E)-N-phenylethanimidothioate
Wiley ID 1522028