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ENDO-METHYL-1-METHYL-5-OXO-7-OXABICYCLO-[2.2.1]-HEPTANE-2-CARBOXYLATE
SpectraBase Compound ID CW2K5huY23w
InChI InChI=1S/C9H12O4/c1-9-4-6(10)7(13-9)3-5(9)8(11)12-2/h5,7H,3-4H2,1-2H3/t5-,7+,9+/m0/s1
InChIKey OPNOMEUTIMYNNS-MTQIGAJGSA-N
Mol Weight 184.19 g/mol
Molecular Formula C9H12O4
Exact Mass 184.073559 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID AFI3Dw6TdmT
Name (1R,2R,4R)-1-Methyl-5-oxo-7-oxa-bicyclo[2.2.1]heptane-2-carboxylic acid methyl ester
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C9H12O4
InChI InChI=1S/C9H12O4/c1-9-4-6(10)7(13-9)3-5(9)8(11)12-2/h5,7H,3-4H2,1-2H3/t5-,7+,9+/m0/s1
InChIKey OPNOMEUTIMYNNS-MTQIGAJGSA-N
Molecular Weight 184.191 g/mol
SMILES [C@@]12([C@@](C[C@@](O2)(C(C1)=O)[H])(C(=O)OC)[H])C
SPLASH splash10-0295-9200000000-f085eebf7b692b061ab8
Source of Spectrum Y-59-338-5
Synonyms Methyl (1R,2R,4R)-1-methyl-5-oxo-7-oxabicyclo[2.2.1]heptane-2-carboxylate Methyl (endo)-1-methyl-5-oxo-7-oxabicyclo[2.2.1]heptane-2-carboxylate
Wiley ID 1583716