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Dimethyl (2S,4aR)-2-Methoxychroman-5,6-dicarboxylate
SpectraBase Compound ID 4wCjT5NsKEa
InChI InChI=1S/C14H18O6/c1-17-11-7-5-8-10(20-11)6-4-9(13(15)18-2)12(8)14(16)19-3/h6,8,11H,4-5,7H2,1-3H3/t8-,11+/m1/s1
InChIKey LLEYJDUAJKSYMK-KCJUWKMLSA-N
Mol Weight 282.29 g/mol
Molecular Formula C14H18O6
Exact Mass 282.110338 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID JucTKd0wK3D
Name Dimethyl (2S,4aR)-2-Methoxychroman-5,6-dicarboxylate
Alternate Name(s) (2S,4aS)-2-Methoxy-3,4,4a,7-tetrahydro-2H-chromene-5,6-dicarboxylic acid dimethyl ester Dimethyl (2S,4aR)-2-methoxy-3,4,4a,8a-tetrahydro-2H-chromene-5,6-dicarboxylate Dimethyl (2S,4aS)-2-Methoxychroman-5,6-dicarboxylate
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Formula C14H18O6
InChI InChI=1S/C14H18O6/c1-17-11-7-5-8-10(20-11)6-4-9(13(15)18-2)12(8)14(16)19-3/h6,8,11H,4-5,7H2,1-3H3/t8-,11+/m1/s1
InChIKey LLEYJDUAJKSYMK-KCJUWKMLSA-N
Molecular Weight 282.292 g/mol
SMILES C1(=C(C(=O)OC)CC=C2[C@]1(CC[C@@](OC)(O2)[H])[H])C(=O)OC
SPLASH splash10-0kc6-9570000000-5222908e4a59e414e990
Source of Spectrum J-58-4987-22
Wiley ID 1285641