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Androst-5-en-3-ol-17-one, 16,16-trimethylenedithio-
SpectraBase Compound ID KcsGHSYbYWQ
InChI InChI=1S/C22H32O2S2/c1-20-8-6-15(23)12-14(20)4-5-16-17(20)7-9-21(2)18(16)13-22(19(21)24)25-10-3-11-26-22/h4,15-18,23H,3,5-13H2,1-2H3
InChIKey JTIZVKFULKANDI-UHFFFAOYSA-N
Mol Weight 392.6 g/mol
Molecular Formula C22H32O2S2
Exact Mass 392.184373 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 9FloUePBDLI
Name 5'-hydroxy-2',15'-dimethylspiro[1,3-dithiane-2,13'-tetracyclo[8.7.0.0(2,7).0(11,15)]heptadecan]-7'-en-14'-one
Copyright Copyright © 2011-2024 Wiley-VCH GmbH. All Rights Reserved.
Exact Mass 392.184372616 u
Formula C22H32O2S2
InChI InChI=1S/C22H32O2S2/c1-20-8-6-15(23)12-14(20)4-5-16-17(20)7-9-21(2)18(16)13-22(19(21)24)25-10-3-11-26-22/h4,15-18,23H,3,5-13H2,1-2H3
InChIKey JTIZVKFULKANDI-UHFFFAOYSA-N
Molecular Weight 392.616 g/mol
Nominal Mass 392 u
Number of Peaks 268
SMILES OC1CCC2(C(C1)=CCC1C2CCC2(C1CC1(C2=O)SCCCS1)C)C
SPLASH splash10-001i-4900000000-c6e009b663461514db25
Source File Reference LMCM-42667-472H
Source of Spectrum Prof. J. Seibl; ETH Zurich, Switzerland
Wiley ID 8_13928