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(4aS,6S,8aR)-(+)-6-Methyloctahydro-2H-1-benzopyran-2-one
SpectraBase Compound ID LpyDYolDB6r
InChI InChI=1S/C10H16O2/c1-7-2-4-9-8(6-7)3-5-10(11)12-9/h7-9H,2-6H2,1H3/t7-,8-,9+/m1/s1
InChIKey VALMPMKNWNIVDM-HLTSFMKQSA-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 AzYC3uE7Bex
Name (4aS,6S,8aR)-(+)-6-Methyloctahydro-2H-1-benzopyran-2-one
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C10H16O2
InChI InChI=1S/C10H16O2/c1-7-2-4-9-8(6-7)3-5-10(11)12-9/h7-9H,2-6H2,1H3/t7-,8-,9+/m1/s1
InChIKey VALMPMKNWNIVDM-HLTSFMKQSA-N
Molecular Weight 168.236 g/mol
SMILES C1(O[C@@]2([C@](CC1)(C[C@@](CC2)(C)[H])[H])[H])=O
SPLASH splash10-00l2-9000000000-423579a7a539d51fe04c
Source of Spectrum QC-11-2611-4
Synonyms (4aR,6R,8aS)-(+)-6-Methyloctahydro-2H-1-benzopyran-2-one (4aS,6S,8aR)-6-methyloctahydro-2H-chromen-2-one
Wiley ID 859942