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8-Methyl-3,4,5,6-tetrahydro-2H-1-benzoxocin
SpectraBase Compound ID 9u3mZGaROnP
InChI InChI=1S/C12H16O/c1-10-6-7-12-11(9-10)5-3-2-4-8-13-12/h6-7,9H,2-5,8H2,1H3
InChIKey PXOCNASZXUPNHM-UHFFFAOYSA-N
Mol Weight 176.26 g/mol
Molecular Formula C12H16O
Exact Mass 176.120115 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID L7YZcRX7wnm
Name 8-Methyl-3,4,5,6-tetrahydro-2H-1-benzoxocin
CAS Registry Number 76429-84-0
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C12H16O
InChI InChI=1S/C12H16O/c1-10-6-7-12-11(9-10)5-3-2-4-8-13-12/h6-7,9H,2-5,8H2,1H3
InChIKey PXOCNASZXUPNHM-UHFFFAOYSA-N
Molecular Weight 176.259 g/mol
SMILES c12c(OCCCCC2)ccc(c1)C
SPLASH splash10-00di-1900000000-a071f5b8a3a6241143ae
Source of Spectrum J-46-1388-0
Wiley ID 1172698