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Spiro-3'-(1'-oxo-2',5'-dioxa-1'-thiacyclopentane)-17(S)-(4,9(10),11-estratriene-3-one)
SpectraBase Compound ID 8TZxFKelHC6
InChI InChI=1S/C19H22O4S/c1-18-8-6-15-14-5-3-13(20)10-12(14)2-4-16(15)17(18)7-9-19(18)11-22-24(21)23-19/h6,8,10,16-17H,2-5,7,9,11H2,1H3/t16?,17?,18-,19+,24?/m0/s1
InChIKey WSAUYCMBGHZAKI-GSDGSHSQSA-N
Mol Weight 346.44 g/mol
Molecular Formula C19H22O4S
Exact Mass 346.12388 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID JlV5FW2cfj2
Name Spiro-3'-(1'-oxo-2',5'-dioxa-1'-thiacyclopentane)-17(S)-(4,9(10),11-estratriene-3-one)
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C19H22O4S
InChI InChI=1S/C19H22O4S/c1-18-8-6-15-14-5-3-13(20)10-12(14)2-4-16(15)17(18)7-9-19(18)11-22-24(21)23-19/h6,8,10,16-17H,2-5,7,9,11H2,1H3/t16?,17?,18-,19+,24?/m0/s1
InChIKey WSAUYCMBGHZAKI-GSDGSHSQSA-N
Molecular Weight 346.441 g/mol
SMILES [C@]12(OS(OC2)=O)[C@@]2(C(C3CCC=4C(=C3C=C2)CCC(=O)C4)CC1)C
SPLASH splash10-0002-1986000000-28ccb09b1fe5288f4c6b
Source of Spectrum E1-35-2126-49
Wiley ID 1574332