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(3aR,7aS)-2-hydroxy-2-methyl-3,3a,5,6,7,7a-hexahydro-1H-inden-4-one
SpectraBase Compound ID 5E65pABnS0X
InChI InChI=1S/C10H16O2/c1-10(12)5-7-3-2-4-9(11)8(7)6-10/h7-8,12H,2-6H2,1H3/t7-,8+,10?/m0/s1
InChIKey ZBNDCTQDZOWJMC-VLCSVPMDSA-N
Mol Weight 168.24 g/mol
Molecular Formula C10H16O2
Exact Mass 168.11503 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID BgV68jHiafK
Name (3aR,7aS)-2-hydroxy-2-methyl-3,3a,5,6,7,7a-hexahydro-1H-inden-4-one
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C10H16O2
InChI InChI=1S/C10H16O2/c1-10(12)5-7-3-2-4-9(11)8(7)6-10/h7-8,12H,2-6H2,1H3/t7-,8+,10?/m0/s1
InChIKey ZBNDCTQDZOWJMC-VLCSVPMDSA-N
Molecular Weight 168.236 g/mol
SMILES OC1(C[C@@]2([C@](C1)(CCCC2=O)[H])[H])C
SPLASH splash10-052f-9200000000-431d2dc660a43f96f5af
Source of Spectrum F-53-8080-13
Synonyms (3aR,7aS)-2-methyl-2-oxidanyl-3,3a,5,6,7,7a-hexahydro-1H-inden-4-one
Wiley ID 802476