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Estra-2,4-dien-3-ol-17-one, O3-TMS
SpectraBase Compound ID LMsdZFCvHqe
InChI InChI=1S/C21H32O2Si/c1-21-12-11-17-16-8-6-15(23-24(2,3)4)13-14(16)5-7-18(17)19(21)9-10-20(21)22/h6,13,16-19H,5,7-12H2,1-4H3/t16?,17?,18?,19?,21-/m0/s1
InChIKey MHLHNZJKAYYMSQ-HSIWFZMLSA-N
Mol Weight 344.6 g/mol
Molecular Formula C21H32O2Si
Exact Mass 344.217157 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID FW3v96cWOZt
Name Estra-2,4-dien-3-ol-17-one, O3-TMS
Copyright Copyright © 2011-2024 Wiley-VCH GmbH. All Rights Reserved.
Exact Mass 344.217156803 u
Formula C21H32O2Si
InChI InChI=1S/C21H32O2Si/c1-21-12-11-17-16-8-6-15(23-24(2,3)4)13-14(16)5-7-18(17)19(21)9-10-20(21)22/h6,13,16-19H,5,7-12H2,1-4H3/t16?,17?,18?,19?,21-/m0/s1
InChIKey MHLHNZJKAYYMSQ-HSIWFZMLSA-N
Molecular Weight 344.570 g/mol
Nominal Mass 344 u
Number of Peaks 42
SMILES C=1(O[Si](C)(C)C)C=C2CCC3C4CCC(=O)[C@@]4(C)CCC3C2CC1
SPLASH splash10-0006-2229000000-095a9a595193172e4d2d
Source File Reference DSHS_50_0507
Source of Spectrum Dr. M.K.Parr, Dr. G.Opfermann, Prof. W.Schaenzer, DSHS Cologne, Germany
Wiley ID 50_507