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2(3H)-Naphthalenone, 5-(1,1-dimethylethoxy)-4,4a,5,6,7,8-hexahydro-1-[2-(3-methoxyphenyl)- 2-oxoethyl]-4a-methyl-, (4aS-cis)-
SpectraBase Compound ID JePCNo9Vynb
InChI InChI=1S/C24H32O4/c1-23(2,3)28-22-11-7-10-19-18(20(25)12-13-24(19,22)4)15-21(26)16-8-6-9-17(14-16)27-5/h6,8-9,14,22H,7,10-13,15H2,1-5H3/t22-,24-/m0/s1
InChIKey PTSWIVLNVMOFIE-UPVQGACJSA-N
Mol Weight 384.5 g/mol
Molecular Formula C24H32O4
Exact Mass 384.23006 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID EHBSDLIWGPd
Name 2(3H)-Naphthalenone, 5-(1,1-dimethylethoxy)-4,4a,5,6,7,8-hexahydro-1-[2-(3-methoxyphenyl)- 2-oxoethyl]-4a-methyl-, (4aS-cis)-
Alternate Name(s) (4aS,5S)-5-tert-butoxy-1-[2-(3-methoxyphenyl)-2-oxoethyl]-4a-methyl-4,4a,5,6,7,8-hexahydro-2(3H)-naphthalenone 17a.beta.-(t-Butoxy)-3-methoxy-D-homo-9,10-secoestra-1,3,5(10),8(14)-tetraen-6,9-dione
CAS Registry Number 65083-12-7
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C24H32O4
InChI InChI=1S/C24H32O4/c1-23(2,3)28-22-11-7-10-19-18(20(25)12-13-24(19,22)4)15-21(26)16-8-6-9-17(14-16)27-5/h6,8-9,14,22H,7,10-13,15H2,1-5H3/t22-,24-/m0/s1
InChIKey PTSWIVLNVMOFIE-UPVQGACJSA-N
Molecular Weight 384.516 g/mol
SMILES C1(=C2[C@]([C@@](OC(C)(C)C)(CCC2)[H])(C)CCC1=O)CC(c1cc(OC)ccc1)=O
SPLASH splash10-002r-1916000000-a4a7cf5bfed3cb7b9964
Source of Spectrum H-60-2265-0
Wiley ID 1361807