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4-Hydroxy-2,6-adamantanedione

View entire compound with spectra: 2 MS (GC)

4-Hydroxy-2,6-adamantanedione
SpectraBase Compound ID 5X0Zm8KPqD5
InChI InChI=1S/C10H12O3/c11-8-4-1-5-3-7(8)10(13)6(2-4)9(5)12/h4-7,10,13H,1-3H2
InChIKey BYMPVYJPJTUAJJ-UHFFFAOYSA-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 Ds6P2MXmykx
Name 4-Hydroxy-2,6-adamantanedione
CAS Registry Number 56781-80-7
Copyright Copyright © 2020-2025 John Wiley & Sons, Inc. All Rights Reserved.
Formula C10H12O3
InChI InChI=1S/C10H12O3/c11-8-4-1-5-3-7(8)10(13)6(2-4)9(5)12/h4-7,10,13H,1-3H2
InChIKey BYMPVYJPJTUAJJ-UHFFFAOYSA-N
Molecular Weight 180.203 g/mol
SMILES OC1C2C(=O)C3CC1C(=O)C(C2)C3
SPLASH splash10-0a5a-9500000000-9be3cdfa522557c1b5ad
Source of Spectrum EP-6374-0-0
Synonyms 4-Hydroxyadamantane-2,6-dione 4-Hydroxyadamantane-2,6-quinone 4-Oxidanyladamantane-2,6-dione (1R,3S,5S,7R)-4-hydroxyadamantane-2,6-dione
Wiley ID 1176196