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Androst-5-ene-3,17-dione, 19-iodo-, cyclic bis(1,2-ethanediyl acetal)
SpectraBase Compound ID GOfjm9Mhp9g
InChI InChI=1S/C23H33IO4/c1-20-6-4-19-17(18(20)5-7-23(20)27-12-13-28-23)3-2-16-14-22(25-10-11-26-22)9-8-21(16,19)15-24/h2,17-19H,3-15H2,1H3/t17-,18-,19-,20-,21+/m0/s1
InChIKey DLBWQVROHHDMDC-UQVNRYHBSA-N
Mol Weight 500.4 g/mol
Molecular Formula C23H33IO4
Exact Mass 500.142355 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID xddX9mSXnU
Name Androst-5-ene-3,17-dione, 19-iodo-, cyclic bis(1,2-ethanediyl acetal)
Alternate Name(s) Dispiro[1,3-dioxolane-2,3'-[3H]cyclopenta[a]phenanthrene-17'(2'H),2''-[1,3]dioxolane], androst-5-ene-3,17-dione deriv. (1'S,2'S,10'S,11'S,15'S)-2'-(iodomethyl)-15'-methyldispiro[1,3-dioxolane-2,5'-tetracyclo[8.7.0.0(2,7).0(11,15)]heptadecane-14',2''-[1,3]dioxolan]-7'-ene 19-Iodoandrost-5-ene-3,17-dione bis(ethylene acetal) Dispiro[1,3-dioxolane-2,3'-[3H]cyclopenta[a]phenanthrene-17'(2'H),2''-[1,3]dioxolane], androst-5-ene-3,17-dione deriv.
CAS Registry Number 102086-74-8
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C23H33IO4
InChI InChI=1S/C23H33IO4/c1-20-6-4-19-17(18(20)5-7-23(20)27-12-13-28-23)3-2-16-14-22(25-10-11-26-22)9-8-21(16,19)15-24/h2,17-19H,3-15H2,1H3/t17-,18-,19-,20-,21+/m0/s1
InChIKey DLBWQVROHHDMDC-UQVNRYHBSA-N
Molecular Weight 500.417 g/mol
SMILES [C@]12(C(=CC[C@]3([C@@]4(CCC5([C@]4(CC[C@]23[H])C)OCCO5)[H])[H])CC2(CC1)OCCO2)CI
SPLASH splash10-01t9-0009000000-e65a43fbe8b1d36f7890
Source of Spectrum KC-1989-1654-13
Wiley ID 1398811