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Farnesiferol A - deuterated cpd.
SpectraBase Compound ID CuUHl5CyN5N
InChI InChI=1S/C24H30O4/c1-15-5-9-20-23(2,3)21(25)11-12-24(20,4)18(15)14-27-17-8-6-16-7-10-22(26)28-19(16)13-17/h6-8,10,13,18,20-21,25H,1,5,9,11-12,14H2,2-4H3/t18-,20+,21+,24-/m0/s1/i25D
InChIKey FCWYNTDTQPCVPG-VNUWJSRXSA-N
Mol Weight 383.51 g/mol
Molecular Formula C24H292DO4
Exact Mass 383.220686 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID CWBGL57KVLg
Name Farnesiferol A - deuterated cpd.
Alternate Name(s) 7-Deuterio)-4-[(2'-oxobenzopyran-7'-yl)oxymethyl]-7-hydroxy-4a,8,8-trimethyl-(perhydro)-naphthalene
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Formula C24H29DO4
InChI InChI=1S/C24H30O4/c1-15-5-9-20-23(2,3)21(25)11-12-24(20,4)18(15)14-27-17-8-6-16-7-10-22(26)28-19(16)13-17/h6-8,10,13,18,20-21,25H,1,5,9,11-12,14H2,2-4H3/t18-,20+,21+,24-/m0/s1/i25D
InChIKey FCWYNTDTQPCVPG-VNUWJSRXSA-N
Molecular Weight 383.506 g/mol
SMILES [C@]12([C@@](C(C)(C)[C@@](CC2)(O[2D])[H])(CCC([C@@]1(COc1cc2OC(=O)C=Cc2cc1)[H])=C)[H])C
SPLASH splash10-0002-2910000000-39c3826eb7df8d23480f
Source of Spectrum X4-13-180-0
Wiley ID 1585126