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Estra-1,3,5(10)-triene, 4,9-dimethyl-15-(1-methylethyl)-, (8.alpha.,9.beta.,13.alpha.,14.beta.,15.beta.)-
SpectraBase Compound ID 8GFMbjh1hBx
InChI InChI=1S/C23H34/c1-15(2)17-11-12-22(4)13-14-23(5)19-8-6-7-16(3)18(19)9-10-20(23)21(17)22/h6-8,15,17,20-21H,9-14H2,1-5H3/t17-,20+,21+,22+,23-/m0/s1
InChIKey GRLLNQFTKYUQKA-JHVSNHCVSA-N
Mol Weight 310.5 g/mol
Molecular Formula C23H34
Exact Mass 310.266051 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 5DG7iQ8fiXs
Name Estra-1,3,5(10)-triene, 4,9-dimethyl-15-(1-methylethyl)-, (8.alpha.,9.beta.,13.alpha.,14.beta.,15.beta.)-
Alternate Name(s) (8alpha,9beta,13alpha,14beta,15beta)-15-isopropyl-4,9-dimethylestra-1,3,5(10)-triene DeS-26-norlupa-5,7,9-triene DeS-a-26-norlupa-5,7,9-triene
CAS Registry Number 127618-12-6
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C23H34
InChI InChI=1S/C23H34/c1-15(2)17-11-12-22(4)13-14-23(5)19-8-6-7-16(3)18(19)9-10-20(23)21(17)22/h6-8,15,17,20-21H,9-14H2,1-5H3/t17-,20+,21+,22+,23-/m0/s1
InChIKey GRLLNQFTKYUQKA-JHVSNHCVSA-N
Molecular Weight 310.525 g/mol
SMILES [C@]12([C@@]([C@]3([C@@](CC[C@@]3(CC2)C)(C(C)C)[H])[H])(CCc2c1cccc2C)[H])C
SPLASH splash10-052b-0940000000-60438f88859533fefc88
Source of Spectrum F-45-6725-10
Wiley ID 1312148