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Deoxy-scitalidin
SpectraBase Compound ID 9h4oyvOMePH
InChI InChI=1S/C22H28O6/c1-3-5-7-9-12-15-14(18-16(12)20(24)28-22(18)26)11(8-6-4-2)10-13-17(15)21(25)27-19(13)23/h11-15,17H,3-10H2,1-2H3
InChIKey CVMLRLWUTOQKDT-UHFFFAOYSA-N
Mol Weight 388.46 g/mol
Molecular Formula C22H28O6
Exact Mass 388.188589 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 4Lkhm2Wmu7I
Name Deoxy-scitalidin
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C22H28O6
InChI InChI=1S/C22H28O6/c1-3-5-7-9-12-15-14(18-16(12)20(24)28-22(18)26)11(8-6-4-2)10-13-17(15)21(25)27-19(13)23/h11-15,17H,3-10H2,1-2H3
InChIKey CVMLRLWUTOQKDT-UHFFFAOYSA-N
Molecular Weight 388.460 g/mol
SMILES C12=C(C(=O)OC2=O)C(CCCCC)C2C3C(OC(C3CC(C12)CCCC)=O)=O
SPLASH splash10-03xr-0098000000-ebd66d51018724b69b91
Source of Spectrum X2-56-1837-2
Wiley ID 1605159