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alpha,alpha'-DIETHYL-4,4'-STILBENEDIOL, DIACETATE
SpectraBase Compound ID 7Yra70hHnen
InChI InChI=1S/C22H24O4/c1-5-21(17-7-11-19(12-8-17)25-15(3)23)22(6-2)18-9-13-20(14-10-18)26-16(4)24/h7-14H,5-6H2,1-4H3/b22-21+
InChIKey NFCAKXYIMSRNLP-QURGRASLSA-N
Mol Weight 352.43 g/mol
Molecular Formula C22H24O4
Exact Mass 352.167459 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 8FvsYh13rGq
Name Diethylstilbestrol 2AC II
Classification Pharmaceutical drug derivative
Copyright Copyright © 2024 DigiLab GmbH and Wiley-VCH GmbH. All Rights Reserved.
Exact Mass 352.167459249 u
Formula C22H24O4
InChI InChI=1S/C22H24O4/c1-5-21(17-7-11-19(12-8-17)25-15(3)23)22(6-2)18-9-13-20(14-10-18)26-16(4)24/h7-14H,5-6H2,1-4H3/b22-21+
InChIKey NFCAKXYIMSRNLP-QURGRASLSA-N
Ionization Type Electron Ionization (EI)
Molecular Weight 352.430 g/mol
Nominal Mass 352 u
Quality 913
Retention Index 2586
SMILES C1(\C(=C\(C2=CC=C(OC(=O)C)C=C2)CC)CC)=CC=C(OC(=O)C)C=C1
SPLASH splash10-0i00-0975000000-2615d6bf3b210513c755
Source of Spectrum DigiLab GmbH (C) 2024
Synonyms 4-(4-(4-(acetyloxy)phenyl)hex-3-en-3-yl)phenyl acetate
Technique GC/MS
Wiley ID DD2024_007805