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(2S)-2-[(1aR,2R,4aS,7R,8aS)-2-acetoxy-1a,4a-dimethyl-5,6,7,8-tetrahydro-2H-naphtho[1,8a-b]oxiren-7-yl]propionic acid methyl ester
SpectraBase Compound ID JjICODZw9lR
InChI InChI=1S/C18H26O5/c1-11(15(20)21-5)13-6-8-16(3)9-7-14(22-12(2)19)17(4)18(16,10-13)23-17/h7,9,11,13-14H,6,8,10H2,1-5H3/t11-,13+,14+,16-,17+,18-/m0/s1
InChIKey IHCKDVCWQHPELD-YFMQAAEASA-N
Mol Weight 322.4 g/mol
Molecular Formula C18H26O5
Exact Mass 322.178024 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID pzf3gRVXzV
Name (2S)-2-[(1aR,2R,4aS,7R,8aS)-2-acetoxy-1a,4a-dimethyl-5,6,7,8-tetrahydro-2H-naphtho[1,8a-b]oxiren-7-yl]propionic acid methyl ester
Alternate Name(s) (2S)-2-[(1aR,2R,4aS,7R,8aS)-2-acetyloxy-1a,4a-dimethyl-5,6,7,8-tetrahydro-2H-naphtho[1,8a-b]oxiren-7-yl]propanoic acid methyl ester Methyl (2S)-2-[(1aR,2R,4aS,7R,8aS)-2-acetoxy-1a,4a-dimethyl-5,6,7,8-tetrahydro-2H-naphtho[1,8a-b]oxiren-7-yl]propanoate Methyl (2S)-2-[(1aR,2R,4aS,7R,8aS)-2-acetyloxy-1a,4a-dimethyl-5,6,7,8-tetrahydro-2H-naphtho[1,8a-b]oxiren-7-yl]propanoate
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Formula C18H26O5
InChI InChI=1S/C18H26O5/c1-11(15(20)21-5)13-6-8-16(3)9-7-14(22-12(2)19)17(4)18(16,10-13)23-17/h7,9,11,13-14H,6,8,10H2,1-5H3/t11-,13+,14+,16-,17+,18-/m0/s1
InChIKey IHCKDVCWQHPELD-YFMQAAEASA-N
Molecular Weight 322.401 g/mol
SMILES [C@]123[C@]([C@](OC(=O)C)(C=C[C@@]3(CC[C@](C1)([C@@](C(=O)OC)(C)[H])[H])C)[H])(C)O2
SPLASH splash10-053r-0090000000-e8c6b094a1483c8a7154
Source of Spectrum F-68-4426-10
Wiley ID 1572605