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2-Methyl-7a-phenyl-3a,4,5,6,7,7a-hexahydrobenzofuran-3-carboxylic acid ethyl ester
SpectraBase Compound ID 1nhHuJlkEvy
InChI InChI=1S/C18H22O3/c1-3-20-17(19)16-13(2)21-18(12-8-7-11-15(16)18)14-9-5-4-6-10-14/h4-6,9-10,15H,3,7-8,11-12H2,1-2H3/t15-,18+/m0/s1
InChIKey UETPJATZTDPGOX-MAUKXSAKSA-N
Mol Weight 286.37 g/mol
Molecular Formula C18H22O3
Exact Mass 286.156895 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 2Rbo689RA5x
Name 2-Methyl-7a-phenyl-3a,4,5,6,7,7a-hexahydrobenzofuran-3-carboxylic acid ethyl ester
Copyright Copyright © 2020-2025 John Wiley & Sons, Inc. All Rights Reserved.
Formula C18H22O3
InChI InChI=1S/C18H22O3/c1-3-20-17(19)16-13(2)21-18(12-8-7-11-15(16)18)14-9-5-4-6-10-14/h4-6,9-10,15H,3,7-8,11-12H2,1-2H3/t15-,18+/m0/s1
InChIKey UETPJATZTDPGOX-MAUKXSAKSA-N
Molecular Weight 286.371 g/mol
SMILES C1(=C(O[C@@]2([C@]1(CCCC2)[H])c1ccccc1)C)C(=O)OCC
SPLASH splash10-05mo-0920000000-2647e2c83875ace9c963
Source of Spectrum KC-0-1490-20
Synonyms (3aS,7aS)-2-Methyl-7a-phenyl-3a,4,5,6,7,7a-hexahydrobenzofuran-3-carboxylic acid ethyl ester Ethyl 2-methyl-7a-phenyl-3a,4,5,6,7,7a-hexahydro-1-benzofuran-3-carboxylate Ethyl (3aS,7aS)-2-methyl-7a-phenyl-4,5,6,7-tetrahydro-3aH-benzofuran-3-carboxylate Ethyl (3aS,7aS)-2-methyl-7a-phenyl-4,5,6,7-tetrahydro-3aH-1-benzofuran-3-carboxylate
Wiley ID 786047