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(3aS,9bR)-2-(methylaminomethyl)-9b-phenyl-2,3,4,5-tetrahydrobenzo[g]benzofuran-3a-carboxylic acid methyl ester
SpectraBase Compound ID BOWssmobpWu
InChI InChI=1S/C22H25NO3/c1-23-15-18-14-21(20(24)25-2)13-12-16-8-6-7-11-19(16)22(21,26-18)17-9-4-3-5-10-17/h3-11,18,23H,12-15H2,1-2H3/t18?,21-,22-/m1/s1
InChIKey DKFQAWWKULDEFA-IPKCRJEZSA-N
Mol Weight 351.45 g/mol
Molecular Formula C22H25NO3
Exact Mass 351.183444 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID HfFUsjggNFB
Name (3aS,9bR)-2-(methylaminomethyl)-9b-phenyl-2,3,4,5-tetrahydrobenzo[g]benzofuran-3a-carboxylic acid methyl ester
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Formula C22H25NO3
InChI InChI=1S/C22H25NO3/c1-23-15-18-14-21(20(24)25-2)13-12-16-8-6-7-11-19(16)22(21,26-18)17-9-4-3-5-10-17/h3-11,18,23H,12-15H2,1-2H3/t18?,21-,22-/m1/s1
InChIKey DKFQAWWKULDEFA-IPKCRJEZSA-N
Molecular Weight 351.446 g/mol
SMILES N(CC1C[C@@]2([C@](O1)(c1ccccc1CC2)c1ccccc1)C(=O)OC)C
SPLASH splash10-0pb9-0093000000-2889976075094b7d269a
Source of Spectrum K1-2004-2713-22
Synonyms Methyl (3aS,9bR)-2-(methylaminomethyl)-9b-phenyl-2,3,4,5-tetrahydrobenzo[g]benzofuran-3a-carboxylate Methyl (3aS,9bR)-2-(methylaminomethyl)-9b-phenyl-2,3,4,5-tetrahydrobenzo[g][1]benzofuran-3a-carboxylate
Wiley ID 1561127