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endo-(3S,4R)-6-ethoxycarbonyl-3,4-(isopropylidenedioxy)-6-vinylbicyclo[3.1.0]hexan-2-one
SpectraBase Compound ID 5ZaPpcOYFkY
InChI InChI=1S/C14H18O5/c1-5-14(12(16)17-6-2)7-8(14)10-11(9(7)15)19-13(3,4)18-10/h5,7-8,10-11H,1,6H2,2-4H3/t7?,8?,10-,11-,14?/m1/s1
InChIKey IHFXOTURZDYASC-SOEQNFCJSA-N
Mol Weight 266.29 g/mol
Molecular Formula C14H18O5
Exact Mass 266.115424 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 58RZrYFYqOT
Name endo-(3S,4R)-6-ethoxycarbonyl-3,4-(isopropylidenedioxy)-6-vinylbicyclo[3.1.0]hexan-2-one
CAS Registry Number 122090-25-9
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C14H18O5
InChI InChI=1S/C14H18O5/c1-5-14(12(16)17-6-2)7-8(14)10-11(9(7)15)19-13(3,4)18-10/h5,7-8,10-11H,1,6H2,2-4H3/t7?,8?,10-,11-,14?/m1/s1
InChIKey IHFXOTURZDYASC-SOEQNFCJSA-N
Molecular Weight 266.293 g/mol
SMILES C1(C2C(=O)[C@@]3([C@@](C12)(OC(C)(C)O3)[H])[H])(C(=O)OCC)C=C
SPLASH splash10-056r-5900000000-ec83c3dde265b99aa75d
Source of Spectrum C-111-6704-27
Synonyms exo-(3S,4R)-6-ethoxycarbonyl-3,4-(isopropylidenedioxy)-6-vinylbicyclo[3.1.0]hexan-2-one Ethyl (3aR,5aS)-2,2-dimethyl-5-oxo-4-vinylhexahydrocyclopropa[3,4]cyclopenta[1,2-d][1,3]dioxole-4-carboxylate
Wiley ID 1269857