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(3aS,7R,7aS)-7,7a-Dihydro-7-hydroxy-2,2-dimethyl-1,3-benzodioxol-4(3aH)-one, 0.2 g/mL, in 0.1M
SpectraBase Compound ID 2LifvRTaWGQ
InChI InChI=1S/C9H12O4/c1-9(2)12-7-5(10)3-4-6(11)8(7)13-9/h3-5,7-8,10H,1-2H3/t5-,7+,8-/m1/s1
InChIKey HGCFQLJTJYOOEV-MHSYXAOVSA-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 43T7PCcH5kl
Name 4-Hydroxy-5,6-[O,O-isopropylidene]-cyclohex-2-en-1-one
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C9H12O4
InChI InChI=1S/C9H12O4/c1-9(2)12-7-5(10)3-4-6(11)8(7)13-9/h3-5,7-8,10H,1-2H3/t5-,7+,8-/m1/s1
InChIKey HGCFQLJTJYOOEV-MHSYXAOVSA-N
Molecular Weight 184.191 g/mol
SMILES O[C@]1([C@]2([C@](OC(C)(C)O2)(C(C=C1)=O)[H])[H])[H]
SPLASH splash10-0002-9600000000-8b15eba6db298ed23713
Source of Spectrum F3-31-236-21
Synonyms (3aS,7R,7aS)-2,2-dimethyl-7-oxidanyl-7,7a-dihydro-3aH-1,3-benzodioxol-4-one
Wiley ID 1565522