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(2R,3S,7aR)-3-methyl-7a-phenethyl-2-phenyl-2,3,6,7-tetrahydropyrrolo[2,1-b]oxazol-5-one
SpectraBase Compound ID 2C2kgjSPO6s
InChI InChI=1S/C21H23NO2/c1-16-20(18-10-6-3-7-11-18)24-21(15-13-19(23)22(16)21)14-12-17-8-4-2-5-9-17/h2-11,16,20H,12-15H2,1H3/t16-,20-,21+/m0/s1
InChIKey PBBGVVVKIGIHJN-ORYQWCPZSA-N
Mol Weight 321.42 g/mol
Molecular Formula C21H23NO2
Exact Mass 321.172879 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID Hpo2Wf9lJ49
Name (2R,3S,7aR)-3-methyl-7a-phenethyl-2-phenyl-2,3,6,7-tetrahydropyrrolo[2,1-b]oxazol-5-one
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C21H23NO2
InChI InChI=1S/C21H23NO2/c1-16-20(18-10-6-3-7-11-18)24-21(15-13-19(23)22(16)21)14-12-17-8-4-2-5-9-17/h2-11,16,20H,12-15H2,1H3/t16-,20-,21+/m0/s1
InChIKey PBBGVVVKIGIHJN-ORYQWCPZSA-N
Molecular Weight 321.420 g/mol
SMILES [C@]12(O[C@@]([C@@](N2C(CC1)=O)(C)[H])(c1ccccc1)[H])CCc1ccccc1
SPLASH splash10-01b9-2890000000-300d77fa87c1ddb83df0
Source of Spectrum KC-60-1241-39
Synonyms (2R,3S,7aR)-3-methyl-2-phenyl-7a-(2-phenylethyl)-2,3,6,7-tetrahydropyrrolo[2,1-b]oxazol-5-one
Wiley ID 1583270