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Methyl (3S,5R) 3,5-Dihydroxycyclohex-1-enecarboxylate
SpectraBase Compound ID GII2DvDhthn
InChI InChI=1S/C8H12O4/c1-12-8(11)5-2-6(9)4-7(10)3-5/h2,6-7,9-10H,3-4H2,1H3/t6-,7-/m1/s1
InChIKey FEFNGZXKDZBHPZ-RNFRBKRXSA-N
Mol Weight 172.18 g/mol
Molecular Formula C8H12O4
Exact Mass 172.073559 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID F42RIEv33n7
Name Methyl (3S,5R) 3,5-Dihydroxycyclohex-1-enecarboxylate
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C8H12O4
InChI InChI=1S/C8H12O4/c1-12-8(11)5-2-6(9)4-7(10)3-5/h2,6-7,9-10H,3-4H2,1H3/t6-,7-/m1/s1
InChIKey FEFNGZXKDZBHPZ-RNFRBKRXSA-N
Molecular Weight 172.180 g/mol
SMILES O[C@]1(C[C@@](CC(=C1)C(=O)OC)(O)[H])[H]
SPLASH splash10-0002-8900000000-7fe3d66524fd13ba2187
Source of Spectrum KD-13-543-4
Synonyms Methyl (3S,5R)-3,5-dihydroxy-1-cyclohexene-1-carboxylate
Wiley ID 1635020