Debug Info

object
{15}
_id
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1sNMG4n5Tk
spectrumID
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1sNMG4n5Tk
cost
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specType
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131072
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WMS3X:448754:1
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properties
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analyticalTechnique
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MS (GC)
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Mass Spectrum (GC)
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compound
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1735074081058
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3.beta.-Hydroxy-17-oxo-5.alpha.-androstan-6.alpha.-yl acetate
SpectraBase Compound ID 8P4KaPPWeq1
InChI InChI=1S/C21H32O4/c1-12(22)25-18-11-14-15-4-5-19(24)21(15,3)9-7-16(14)20(2)8-6-13(23)10-17(18)20/h13-18,23H,4-11H2,1-3H3/t13-,14?,15?,16?,17+,18-,20+,21-/m0/s1
InChIKey WUDUVFSTMUTVNY-WJINQKIYSA-N
Mol Weight 348.5 g/mol
Molecular Formula C21H32O4
Exact Mass 348.23006 g/mol
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Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 1sNMG4n5Tk
Name 3.beta.-Hydroxy-17-oxo-5.alpha.-androstan-6.alpha.-yl acetate
Copyright Copyright © 2020-2025 John Wiley & Sons, Inc. All Rights Reserved.
Formula C21H32O4
InChI InChI=1S/C21H32O4/c1-12(22)25-18-11-14-15-4-5-19(24)21(15,3)9-7-16(14)20(2)8-6-13(23)10-17(18)20/h13-18,23H,4-11H2,1-3H3/t13-,14?,15?,16?,17+,18-,20+,21-/m0/s1
InChIKey WUDUVFSTMUTVNY-WJINQKIYSA-N
Molecular Weight 348.483 g/mol
SMILES O[C@]1(CC[C@@]2(C3C(C4CCC([C@]4(CC3)C)=O)C[C@@]([C@]2(C1)[H])(OC(=O)C)[H])C)[H]
SPLASH splash10-006x-6091000000-49184fc5872064994fe0
Source of Spectrum H-79-1003-3
Synonyms (3beta,5alpha,6alpha)-3-hydroxy-17-oxoandrostan-6-yl acetate
Wiley ID 1340864
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