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20-Formyl-19-nor-pregna-5,7,9-trien-3.beta.-yl Acetate
SpectraBase Compound ID 3KL6Mgw0BWW
InChI InChI=1S/C23H30O3/c1-14(13-24)21-8-9-22-20-6-4-16-12-17(26-15(2)25)5-7-18(16)19(20)10-11-23(21,22)3/h4,6,13-14,17,21-22H,5,7-12H2,1-3H3/t14-,17+,21-,22?,23-/m1/s1
InChIKey QEEIWRIKSKZSBK-NVMSAZPISA-N
Mol Weight 354.49 g/mol
Molecular Formula C23H30O3
Exact Mass 354.219495 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 7BsaS9ApZTx
Name 20-Formyl-19-nor-pregna-5,7,9-trien-3.beta.-yl Acetate
Alternate Name(s) (3beta,17beta)-17-[(1S)-1-methyl-2-oxoethyl]estra-5,7,9-trien-3-yl acetate
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C23H30O3
InChI InChI=1S/C23H30O3/c1-14(13-24)21-8-9-22-20-6-4-16-12-17(26-15(2)25)5-7-18(16)19(20)10-11-23(21,22)3/h4,6,13-14,17,21-22H,5,7-12H2,1-3H3/t14-,17+,21-,22?,23-/m1/s1
InChIKey QEEIWRIKSKZSBK-NVMSAZPISA-N
Molecular Weight 354.490 g/mol
SMILES [C@@]12(C(c3ccc4c(c3CC2)CC[C@](OC(=O)C)(C4)[H])CC[C@@]1([C@@](C=O)(C)[H])[H])C
SPLASH splash10-03di-0369000000-a5e4bacbdcb1d5583d6c
Source of Spectrum G4-61-1494-23
Wiley ID 1607605