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(4aS*,7S*,8aR*)-6,7-Dimethyl-3,4,4a,7,8,8a-hexahydro-1H-isochromene-1-one
SpectraBase Compound ID 4IPGWBA0J1b
InChI InChI=1S/C11H16O2/c1-7-5-9-3-4-13-11(12)10(9)6-8(7)2/h5,8-10H,3-4,6H2,1-2H3/t8-,9-,10+/m0/s1
InChIKey LKZJKMVEMMDODZ-LPEHRKFASA-N
Mol Weight 180.25 g/mol
Molecular Formula C11H16O2
Exact Mass 180.11503 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID H0ROVlPxANb
Name (4aS*,7S*,8aR*)-6,7-Dimethyl-3,4,4a,7,8,8a-hexahydro-1H-isochromene-1-one
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C11H16O2
InChI InChI=1S/C11H16O2/c1-7-5-9-3-4-13-11(12)10(9)6-8(7)2/h5,8-10H,3-4,6H2,1-2H3/t8-,9-,10+/m0/s1
InChIKey LKZJKMVEMMDODZ-LPEHRKFASA-N
Molecular Weight 180.247 g/mol
SMILES [C@@]12(C(OCC[C@]1(C=C(C)[C@](C2)(C)[H])[H])=O)[H]
SPLASH splash10-0a7o-5900000000-300c93114f6313124d06
Source of Spectrum F-67-191-23i
Wiley ID 1685344