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1,4-Naphthalenedione, 8-(ethoxymethylene)-4a,5,8,8a-tetrahydro-2,6,8a-trimethyl-, (4a.alpha.,8E,8a.alpha.)-
SpectraBase Compound ID L88AgXGZJMP
InChI InChI=1S/C16H20O3/c1-5-19-9-12-6-10(2)7-13-14(17)8-11(3)15(18)16(12,13)4/h6,8-9,13H,5,7H2,1-4H3/b12-9+/t13-,16-/m1/s1
InChIKey HFYQUIVFYVUCLD-UMBJVVCDSA-N
Mol Weight 260.33 g/mol
Molecular Formula C16H20O3
Exact Mass 260.141245 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID B0INsSi8FW4
Name 1,4-Naphthalenedione, 8-(ethoxymethylene)-4a,5,8,8a-tetrahydro-2,6,8a-trimethyl-, (4a.alpha.,8E,8a.alpha.)-
CAS Registry Number 103108-87-8
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C16H20O3
InChI InChI=1S/C16H20O3/c1-5-19-9-12-6-10(2)7-13-14(17)8-11(3)15(18)16(12,13)4/h6,8-9,13H,5,7H2,1-4H3/b12-9+/t13-,16-/m1/s1
InChIKey HFYQUIVFYVUCLD-UMBJVVCDSA-N
Molecular Weight 260.333 g/mol
SMILES [C@@]12(\C(C=C(C[C@@]2(C(=O)C=C(C1=O)C)[H])C)=C\OCC)C
SPLASH splash10-03dm-3290000000-d4915d9e643d97e4ecb3
Source of Spectrum H-68-1138-7
Synonyms (4aS,8E,8aS)-8-(ethoxymethylene)-2,6,8a-trimethyl-4a,5,8,8a-tetrahydro-1,4-naphthalenedione 5-[(E)-ethoxymethyliden]-3,4a.alpha.,7-trimethyl-4a.alpha.,5,8,8a-tetrahydro-1,4-naphthalindion
Wiley ID 1264018