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(1S,5R,8S)-3-Methyl-7-oxo-6-oxa-bicyclo[3.2.1]oct-3-ene-8-carboxylic acid methyl ester
SpectraBase Compound ID KEJDOV443XQ
InChI InChI=1S/C10H12O4/c1-5-3-6-8(10(12)13-2)7(4-5)14-9(6)11/h4,6-8H,3H2,1-2H3/t6-,7+,8-/m0/s1
InChIKey PCNRGTZOLNRULK-RNJXMRFFSA-N
Mol Weight 196.2 g/mol
Molecular Formula C10H12O4
Exact Mass 196.073559 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID JkX2LMuJnyD
Name (1S,5R,8S)-3-Methyl-7-oxo-6-oxa-bicyclo[3.2.1]oct-3-ene-8-carboxylic acid methyl ester
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C10H12O4
InChI InChI=1S/C10H12O4/c1-5-3-6-8(10(12)13-2)7(4-5)14-9(6)11/h4,6-8H,3H2,1-2H3/t6-,7+,8-/m0/s1
InChIKey PCNRGTZOLNRULK-RNJXMRFFSA-N
Molecular Weight 196.202 g/mol
SMILES [C@]1([C@]2(C(=O)O[C@@]1(C=C(C2)C)[H])[H])(C(=O)OC)[H]
SPLASH splash10-0a4l-2900000000-83ba144cecc41d3ff8d4
Source of Spectrum C-117-1924-12
Synonyms Methyl (anti)-3-methyl-7-oxo-6-oxabicyclo[3.2.1]oct-6-ene-8-carboxylate
Wiley ID 1697548