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Androst-5-en-17-one, 3-(acetyloxy)-16-[[bis(1-methylethyl)amino]methylene]-, (3.beta.)-
SpectraBase Compound ID AuHfs4OBTmH
InChI InChI=1S/C28H43NO3/c1-17(2)29(18(3)4)16-20-14-25-23-9-8-21-15-22(32-19(5)30)10-12-27(21,6)24(23)11-13-28(25,7)26(20)31/h8,16-18,22-25H,9-15H2,1-7H3/b20-16+/t22-,23+,24-,25-,27-,28-/m0/s1
InChIKey UBSGSTMUHCORRI-IMGHZCNPSA-N
Mol Weight 441.7 g/mol
Molecular Formula C28H43NO3
Exact Mass 441.324294 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID EOAtzNYI9WI
Name Androst-5-en-17-one, 3-(acetyloxy)-16-[[bis(1-methylethyl)amino]methylene]-, (3.beta.)-
CAS Registry Number 63518-05-8
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C28H43NO3
InChI InChI=1S/C28H43NO3/c1-17(2)29(18(3)4)16-20-14-25-23-9-8-21-15-22(32-19(5)30)10-12-27(21,6)24(23)11-13-28(25,7)26(20)31/h8,16-18,22-25H,9-15H2,1-7H3/b20-16+/t22-,23+,24-,25-,27-,28-/m0/s1
InChIKey UBSGSTMUHCORRI-IMGHZCNPSA-N
Molecular Weight 441.656 g/mol
SMILES C1(\C(C[C@]2([C@@]3(CC=C4C[C@](CC[C@@]4([C@]3(CC[C@]12C)[H])C)(OC(=O)C)[H])[H])[H])=C\N(C(C)C)C(C)C)=O
SPLASH splash10-000g-9208200000-9c6e88c18aafb9d7d2ba
Source of Spectrum F-32-3000-0
Synonyms (3beta)-16-[(diisopropylamino)methylene]-17-oxoandrost-5-en-3-yl acetate 3.beta.-acetoxy-16-diisopropylamino-methylenandrost-5-en-17-one
Wiley ID 1385125