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(1S,2S,4aR,8aS)-1-(4-methoxy-phenyl)-6-oxo-1,2,3,4,4a,5,6,8a-octahydro-naphthalene-2-carbaldehyde
SpectraBase Compound ID 1NtIwqhCN2C
InChI InChI=1S/C18H20O3/c1-21-16-7-4-12(5-8-16)18-14(11-19)3-2-13-10-15(20)6-9-17(13)18/h4-9,11,13-14,17-18H,2-3,10H2,1H3/t13-,14-,17-,18-/m1/s1
InChIKey GWKJKVCEVGGVBT-DTTOXWODSA-N
Mol Weight 284.36 g/mol
Molecular Formula C18H20O3
Exact Mass 284.141245 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 4Ql2igYDDM2
Name (1S,2S,4aR,8aS)-1-(4-methoxy-phenyl)-6-oxo-1,2,3,4,4a,5,6,8a-octahydro-naphthalene-2-carbaldehyde
Alternate Name(s) 1,2,3,4,4a,5,6,8a-Octahydro-6-oxo-1-(p-methoxyphenyl)-naphthalene-2-carbaldehyde
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C18H20O3
InChI InChI=1S/C18H20O3/c1-21-16-7-4-12(5-8-16)18-14(11-19)3-2-13-10-15(20)6-9-17(13)18/h4-9,11,13-14,17-18H,2-3,10H2,1H3/t13-,14-,17-,18-/m1/s1
InChIKey GWKJKVCEVGGVBT-DTTOXWODSA-N
Molecular Weight 284.355 g/mol
SMILES [C@@]12(C=CC(C[C@]2(CC[C@@]([C@]1(c1ccc(OC)cc1)[H])(C=O)[H])[H])=O)[H]
SPLASH splash10-00di-1910000000-1109fd6c6917a65b8424
Source of Spectrum F5-7-3099-5c
Wiley ID 1696659