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1,2-Azulenedicarboxylic acid, 3,8a-dihydro-3-methoxy-, dimethyl ester, cis-(.+-.)-
SpectraBase Compound ID 49af66XOslm
InChI InChI=1S/C15H16O5/c1-18-13-10-8-6-4-5-7-9(10)11(14(16)19-2)12(13)15(17)20-3/h4-9,13H,1-3H3/t9-,13-/m1/s1
InChIKey GVKZEIYSPDLQLR-NOZJJQNGSA-N
Mol Weight 276.29 g/mol
Molecular Formula C15H16O5
Exact Mass 276.099774 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID JNSJKUswSHi
Name 1,2-Azulenedicarboxylic acid, 3,8a-dihydro-3-methoxy-, dimethyl ester, cis-(.+-.)-
Alternate Name(s) cis-3,8a-dihydro-3-methoxy-1,2-azulendicarbonsaure-dimethylester Dimethyl (3R,8aR)-3-methoxy-3,8a-dihydro-1,2-azulenedicarboxylate
CAS Registry Number 82452-84-4
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C15H16O5
InChI InChI=1S/C15H16O5/c1-18-13-10-8-6-4-5-7-9(10)11(14(16)19-2)12(13)15(17)20-3/h4-9,13H,1-3H3/t9-,13-/m1/s1
InChIKey GVKZEIYSPDLQLR-NOZJJQNGSA-N
Molecular Weight 276.288 g/mol
SMILES C1(=C([C@@]2(C=CC=CC=C2[C@]1(OC)[H])[H])C(=O)OC)C(=O)OC
SPLASH splash10-014l-0090000000-4e28f771f21338df1053
Source of Spectrum K-118-1849-11
Wiley ID 1280002