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(2S)-2-[(3R,7R,8aR)-5-keto-3-phenyl-2,3,6,7,8,8a-hexahydrooxazolo[3,2-a]pyridin-7-yl]-2-(1-methylindol-2-yl)acetic acid methyl ester

View entire compound with spectra: 1 MS (GC)

(2S)-2-[(3R,7R,8aR)-5-keto-3-phenyl-2,3,6,7,8,8a-hexahydrooxazolo[3,2-a]pyridin-7-yl]-2-(1-methylindol-2-yl)acetic acid methyl ester
SpectraBase Compound ID FlUCKxbHUaM
InChI InChI=1S/C25H26N2O4/c1-26-19-11-7-6-10-17(19)12-20(26)24(25(29)30-2)18-13-22(28)27-21(15-31-23(27)14-18)16-8-4-3-5-9-16/h3-12,18,21,23-24H,13-15H2,1-2H3/t18-,21-,23+,24-/m0/s1
InChIKey USKAQLIHROQSKG-CJOZULMCSA-N
Mol Weight 418.49 g/mol
Molecular Formula C25H26N2O4
Exact Mass 418.189257 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID HrvW0hJV4Y1
Name (2S)-2-[(3R,7R,8aR)-5-keto-3-phenyl-2,3,6,7,8,8a-hexahydrooxazolo[3,2-a]pyridin-7-yl]-2-(1-methylindol-2-yl)acetic acid methyl ester
Alternate Name(s) (2S)-2-[(3R,7R,8aR)-5-oxo-3-phenyl-2,3,6,7,8,8a-hexahydrooxazolo[3,2-a]pyridin-7-yl]-2-(1-methyl-2-indolyl)acetic acid methyl ester Methyl (2S)-2-[(3R,7R,8aR)-5-oxidanylidene-3-phenyl-2,3,6,7,8,8a-hexahydro-[1,3]oxazolo[3,2-a]pyridin-7-yl]-2-(1-methylindol-2-yl)ethanoate Methyl (2S)-2-[(3R,7R,8aR)-5-oxo-3-phenyl-2,3,6,7,8,8a-hexahydro-[1,3]oxazolo[3,2-a]pyridin-7-yl]-2-(1-methylindol-2-yl)acetate Methyl (2S)-2-[(3R,7R,8aR)-5-oxo-3-phenyl-2,3,6,7,8,8a-hexahydrooxazolo[3,2-a]pyridin-7-yl]-2-(1-methylindol-2-yl)acetate
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Formula C25H26N2O4
InChI InChI=1S/C25H26N2O4/c1-26-19-11-7-6-10-17(19)12-20(26)24(25(29)30-2)18-13-22(28)27-21(15-31-23(27)14-18)16-8-4-3-5-9-16/h3-12,18,21,23-24H,13-15H2,1-2H3/t18-,21-,23+,24-/m0/s1
InChIKey USKAQLIHROQSKG-CJOZULMCSA-N
Molecular Weight 418.493 g/mol
SMILES c1([n](c2ccccc2c1)C)[C@]([C@]1(CC(=O)N2[C@@](C1)(OC[C@]2(c1ccccc1)[H])[H])[H])(C(=O)OC)[H]
SPLASH splash10-0a70-0904100000-3f5580680f843e11c197
Source of Spectrum F-69-8689-6
Wiley ID 1595943