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9-Acetyl-2,6-dimethyl-10-hydroxybicyclo[4.4.0]deca-1,4-dien-3-one
SpectraBase Compound ID AGS9pHEDMra
InChI InChI=1S/C14H18O3/c1-8-7-14(3)5-4-10(9(2)15)13(17)11(14)6-12(8)16/h6-7,10,13,17H,4-5H2,1-3H3/t10-,13-,14-/m0/s1
InChIKey WZZXIEADNLYDOO-BPNCWPANSA-N
Mol Weight 234.29 g/mol
Molecular Formula C14H18O3
Exact Mass 234.125594 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 92UdGXgyhUW
Name 9-Acetyl-2,6-dimethyl-10-hydroxybicyclo[4.4.0]deca-1,4-dien-3-one
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C14H18O3
InChI InChI=1S/C14H18O3/c1-8-7-14(3)5-4-10(9(2)15)13(17)11(14)6-12(8)16/h6-7,10,13,17H,4-5H2,1-3H3/t10-,13-,14-/m0/s1
InChIKey WZZXIEADNLYDOO-BPNCWPANSA-N
Molecular Weight 234.295 g/mol
SMILES O[C@@]1(C=2[C@](C=C(C(C2)=O)C)(CC[C@]1(C(=O)C)[H])C)[H]
SPLASH splash10-0g4i-0690000000-42d099a521175c9f7919
Source of Spectrum F-50-5444-3
Synonyms (4aS,7R,8S)-7-Acetyl-8-hydroxy-3,4a-dimethyl-5,6,7,8-tetrahydro-4aH-naphthalen-2-one 7-Acetyl-8-hydroxy-3,4a-dimethyl-5,6,7,8-tetrahydro-2(4aH)-naphthalenone
Wiley ID 1236196