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3,7-Dihydroxy-6,10,10-trimethylbicyclo[4.4.0]deca-1,8-dien-5-one
SpectraBase Compound ID A1lQpxnmTfe
InChI InChI=1S/C13H18O3/c1-12(2)5-4-10(15)13(3)9(12)6-8(14)7-11(13)16/h4-6,8,10,14-15H,7H2,1-3H3/t8-,10-,13+/m0/s1
InChIKey SDKUYJWZYPJMJF-GMOODISLSA-N
Mol Weight 222.28 g/mol
Molecular Formula C13H18O3
Exact Mass 222.125594 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID BmG3iaJz9vE
Name 3,7-Dihydroxy-6,10,10-trimethylbicyclo[4.4.0]deca-1,8-dien-5-one
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C13H18O3
InChI InChI=1S/C13H18O3/c1-12(2)5-4-10(15)13(3)9(12)6-8(14)7-11(13)16/h4-6,8,10,14-15H,7H2,1-3H3/t8-,10-,13+/m0/s1
InChIKey SDKUYJWZYPJMJF-GMOODISLSA-N
Molecular Weight 222.284 g/mol
SMILES O[C@]1(C=C2[C@]([C@](C=CC2(C)C)(O)[H])(C(C1)=O)C)[H]
SPLASH splash10-000f-9210000000-eda3623eecca81827612
Source of Spectrum F-50-8418-53
Synonyms (3R,8S,8aR)-3,8-Dihydroxy-5,5,8a-trimethyl-3,5,8,8a-tetrahydro-2H-naphthalen-1-one 3,8-Dihydroxy-5,5,8a-trimethyl-3,5,8,8a-tetrahydro-1(2H)-naphthalenone
Wiley ID 1222689