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(3R,5R) 3-Acetoxy-1-ethynyl-5-hydroxycyclohex-1-ene
SpectraBase Compound ID 95wSyDBiA6W
InChI InChI=1S/C10H12O3/c1-3-8-4-9(12)6-10(5-8)13-7(2)11/h1,5,9-10,12H,4,6H2,2H3/t9-,10+/m1/s1
InChIKey ZLKDDMDFVIYXFZ-ZJUUUORDSA-N
Mol Weight 180.2 g/mol
Molecular Formula C10H12O3
Exact Mass 180.078644 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 1Rgq8W1qZZY
Name (3R,5R) 3-Acetoxy-1-ethynyl-5-hydroxycyclohex-1-ene
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C10H12O3
InChI InChI=1S/C10H12O3/c1-3-8-4-9(12)6-10(5-8)13-7(2)11/h1,5,9-10,12H,4,6H2,2H3/t9-,10+/m1/s1
InChIKey ZLKDDMDFVIYXFZ-ZJUUUORDSA-N
Molecular Weight 180.203 g/mol
SMILES O[C@]1(C[C@](C=C(C#C)C1)(OC(=O)C)[H])[H]
SPLASH splash10-006x-6900000000-34b6e89cd2142053478f
Source of Spectrum KD-13-544-21
Synonyms (3R,5R)-3-Acetoxy-1-ethynyl-5-hydroxycyclohex-1-ene (1R,5R)-3-ethynyl-5-hydroxy-2-cyclohexen-1-yl acetate
Wiley ID 1635013