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(4aRS,7SR)-3-Methoxy-5,6-dihydro-4a,7-methano-4aH-benzocyclohepten-8(7)H)-one
SpectraBase Compound ID ZADqayRZjM
InChI InChI=1S/C13H14O2/c1-15-11-3-2-10-6-12(14)9-4-5-13(10,7-9)8-11/h2-3,6,8-9H,4-5,7H2,1H3
InChIKey NYCJGQBVGHPIEP-UHFFFAOYSA-N
Mol Weight 202.25 g/mol
Molecular Formula C13H14O2
Exact Mass 202.09938 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 2knxvNtlIG
Name (4aRS,7SR)-3-Methoxy-5,6-dihydro-4a,7-methano-4aH-benzocyclohepten-8(7)H)-one
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C13H14O2
InChI InChI=1S/C13H14O2/c1-15-11-3-2-10-6-12(14)9-4-5-13(10,7-9)8-11/h2-3,6,8-9H,4-5,7H2,1H3
InChIKey NYCJGQBVGHPIEP-UHFFFAOYSA-N
Molecular Weight 202.253 g/mol
SMILES C123C(=CC(C(C3)CC1)=O)C=CC(=C2)OC
SPLASH splash10-0uxv-9600000000-271641f8a6c25695df85
Source of Spectrum SO-0-461-10
Wiley ID 875374