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3-Methoxy-10-methoxycarbonyl-4-oxatricyclo[5.3.1.0(3,8)]undec-9-en-2-one
SpectraBase Compound ID F88GASdvMX
InChI InChI=1S/C13H16O5/c1-16-12(15)9-6-10-7-3-4-18-13(10,17-2)11(14)8(9)5-7/h6-8,10H,3-5H2,1-2H3/t7-,8+,10+,13-/m0/s1
InChIKey ULDYEQZTBDGALO-DUCCMJIMSA-N
Mol Weight 252.27 g/mol
Molecular Formula C13H16O5
Exact Mass 252.099774 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID mUrhx1pWm9
Name 3-Methoxy-10-methoxycarbonyl-4-oxatricyclo[5.3.1.0(3,8)]undec-9-en-2-one
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C13H16O5
InChI InChI=1S/C13H16O5/c1-16-12(15)9-6-10-7-3-4-18-13(10,17-2)11(14)8(9)5-7/h6-8,10H,3-5H2,1-2H3/t7-,8+,10+,13-/m0/s1
InChIKey ULDYEQZTBDGALO-DUCCMJIMSA-N
Molecular Weight 252.266 g/mol
SMILES [C@@]12(C([C@]3(C(=C[C@@]2([C@](C3)(CCO1)[H])[H])C(=O)OC)[H])=O)OC
SPLASH splash10-00di-3390000000-ea97b214883d2ec89984
Source of Spectrum J-64-4117-17
Synonyms (1S*,3R*,7S*,8R*)-3-Methoxy-10-methoxycarbonyl-4-oxatricyclo[5.3.1.0(3,8)]undec-9-en-2-one Methyl 3-methoxy-2-oxo-4-oxatricyclo[5.3.1.0(3,8)]undec-9-ene-10-carboxylate
Wiley ID 1530285