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1,1-Dimethyl-4a-D3-methyl-1,2,3,4,4a,9,10,10a-octahydro-2-oxophenanthrene
SpectraBase Compound ID JqsLnwpBy64
InChI InChI=1S/C17H22O/c1-16(2)14-9-8-12-6-4-5-7-13(12)17(14,3)11-10-15(16)18/h4-7,14H,8-11H2,1-3H3/i3D3
InChIKey FREICZOWKOVUIG-HPRDVNIFSA-N
Mol Weight 245.38 g/mol
Molecular Formula C17H192D3O
Exact Mass 245.185896 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 5AiC75Ewu3p
Name 1,1-Dimethyl-4a-D3-methyl-1,2,3,4,4a,9,10,10a-octahydro-2-oxophenanthrene
CAS Registry Number 55902-89-1
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C17H19D3O
InChI InChI=1S/C17H22O/c1-16(2)14-9-8-12-6-4-5-7-13(12)17(14,3)11-10-15(16)18/h4-7,14H,8-11H2,1-3H3/i3D3
InChIKey FREICZOWKOVUIG-HPRDVNIFSA-N
Molecular Weight 245.380 g/mol
SMILES C12(C(C(C)(C)C(CC2)=O)CCc2c1cccc2)C([2D])([2D])[2D]
SPLASH splash10-004s-0920000000-5d1b8eef01bdb56ce99b
Source of Spectrum O-9-499-1
Wiley ID 1245641