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(3S,6S,7aR)-6-Benzyl-3-tert-butyl-1,6,7,7a-tetrahydro-5-oxopyrrolo[1,2-c]oxazolidine-7a-carboxylic acid 7a-methyl ester
SpectraBase Compound ID 3sjabohMSA5
InChI InChI=1S/C19H25NO4/c1-18(2,3)16-20-15(21)14(10-13-8-6-5-7-9-13)11-19(20,12-24-16)17(22)23-4/h5-9,14,16H,10-12H2,1-4H3/t14-,16-,19+/m0/s1
InChIKey ZABHWQGNDRRZLC-URLQWDBASA-N
Mol Weight 331.41 g/mol
Molecular Formula C19H25NO4
Exact Mass 331.178358 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID J3Y6A2puIFN
Name (3S,6S,7aR)-6-Benzyl-3-tert-butyl-1,6,7,7a-tetrahydro-5-oxopyrrolo[1,2-c]oxazolidine-7a-carboxylic acid 7a-methyl ester
Alternate Name(s) (3S,6S,7aR)-3-tert-butyl-5-oxo-6-(phenylmethyl)-1,3,6,7-tetrahydropyrrolo[1,2-c]oxazole-7a-carboxylic acid methyl ester Methyl (3S,6S,7aR)-6-benzyl-3-tert-butyl-5-oxo-1,3,6,7-tetrahydropyrrolo[1,2-c][1,3]oxazole-7a-carboxylate Methyl (3S,6S,7aR)-6-benzyl-3-tert-butyl-5-oxo-1,3,6,7-tetrahydropyrrolo[1,2-c]oxazole-7a-carboxylate Methyl (3S,6S,7aR)-3-tert-butyl-5-oxidanylidene-6-(phenylmethyl)-1,3,6,7-tetrahydropyrrolo[1,2-c][1,3]oxazole-7a-carboxylate
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Formula C19H25NO4
InChI InChI=1S/C19H25NO4/c1-18(2,3)16-20-15(21)14(10-13-8-6-5-7-9-13)11-19(20,12-24-16)17(22)23-4/h5-9,14,16H,10-12H2,1-4H3/t14-,16-,19+/m0/s1
InChIKey ZABHWQGNDRRZLC-URLQWDBASA-N
Molecular Weight 331.412 g/mol
SMILES [C@@]12(N(C(=O)[C@](C2)(Cc2ccccc2)[H])[C@](C(C)(C)C)(OC1)[H])C(=O)OC
SPLASH splash10-0006-9040000000-9497bde677e4c48c8710
Source of Spectrum J-66-7558-14
Wiley ID 1568373