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7.alpha.-Ethoxycarbonyl-3-methoxy-(1H.beta.,6H.beta.)-bicyclo[4.2.1]nona-2,4-diene
SpectraBase Compound ID IkcMCr6zMYd
InChI InChI=1S/C13H18O3/c1-3-16-13(14)12-8-9-6-10(12)4-5-11(7-9)15-2/h4-5,7,9-10,12H,3,6,8H2,1-2H3/t9-,10-,12+/m1/s1
InChIKey ZCUZVCSCLNCZRG-FOGDFJRCSA-N
Mol Weight 222.28 g/mol
Molecular Formula C13H18O3
Exact Mass 222.125594 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID AlwfLwgXrf5
Name 7.alpha.-Ethoxycarbonyl-3-methoxy-(1H.beta.,6H.beta.)-bicyclo[4.2.1]nona-2,4-diene
Alternate Name(s) Ethyl (1R,6S,7S)-3-methoxybicyclo[4.2.1]nona-2,4-diene-7-carboxylate
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C13H18O3
InChI InChI=1S/C13H18O3/c1-3-16-13(14)12-8-9-6-10(12)4-5-11(7-9)15-2/h4-5,7,9-10,12H,3,6,8H2,1-2H3/t9-,10-,12+/m1/s1
InChIKey ZCUZVCSCLNCZRG-FOGDFJRCSA-N
Molecular Weight 222.284 g/mol
SMILES [C@@]1([C@@]2(C=CC(=C[C@@](C1)([H])C2)OC)[H])(C(=O)OCC)[H]
SPLASH splash10-05fr-0910000000-4dc9188f123feea982fd
Source of Spectrum F-49-5503-9
Wiley ID 1222686