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Androst-4-ene-3,17-dione, 2,19-bis(acetyloxy)-, (2.alpha.)-
SpectraBase Compound ID A2YHL0XUlIG
InChI InChI=1S/C23H30O6/c1-13(24)28-12-23-11-20(29-14(2)25)19(26)10-15(23)4-5-16-17-6-7-21(27)22(17,3)9-8-18(16)23/h10,16-18,20H,4-9,11-12H2,1-3H3/t16-,17-,18-,20+,22-,23+/m0/s1
InChIKey JRCOIOVDHXIKGD-BAXYXCLMSA-N
Mol Weight 402.49 g/mol
Molecular Formula C23H30O6
Exact Mass 402.204239 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID C1J2XjpxKJE
Name Androst-4-ene-3,17-dione, 2,19-bis(acetyloxy)-, (2.alpha.)-
Alternate Name(s) (2alpha)-19-(acetyloxy)-3,17-dioxoandrost-4-en-2-yl acetate 2.alpha.,19-diacetoxyandrost-4-ene-3,17-dione
CAS Registry Number 53874-99-0
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C23H30O6
InChI InChI=1S/C23H30O6/c1-13(24)28-12-23-11-20(29-14(2)25)19(26)10-15(23)4-5-16-17-6-7-21(27)22(17,3)9-8-18(16)23/h10,16-18,20H,4-9,11-12H2,1-3H3/t16-,17-,18-,20+,22-,23+/m0/s1
InChIKey JRCOIOVDHXIKGD-BAXYXCLMSA-N
Molecular Weight 402.487 g/mol
SMILES [C@@]12(C(=CC([C@@](C2)(OC(=O)C)[H])=O)CC[C@]2([C@@]3(CCC([C@]3(CC[C@]12[H])C)=O)[H])[H])COC(=O)C
SPLASH splash10-0f6x-9008200000-3cccdd65e93bcce3e237
Source of Spectrum KC-1990-2902-15
Wiley ID 1370426