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Trichloroacetimido-3.beta.-cholestanol
SpectraBase Compound ID C2GYmFAAO6H
InChI InChI=1S/C29H48Cl3NO/c1-18(2)7-6-8-19(3)23-11-12-24-22-10-9-20-17-21(34-26(33)29(30,31)32)13-15-27(20,4)25(22)14-16-28(23,24)5/h18-25,33H,6-17H2,1-5H3/t19?,20?,21-,22?,23?,24?,25?,27?,28?/m0/s1
InChIKey DLBZNTLSHAAHHR-OVPJGOJDSA-N
Mol Weight 533.1 g/mol
Molecular Formula C29H48Cl3NO
Exact Mass 531.280148 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID ASWE6YGzPA9
Name Trichloroacetimido-3.beta.-cholestanol
Alternate Name(s) (3beta)-cholestan-3-yl 2,2,2-trichloroethanimidoate
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Formula C29H48Cl3NO
InChI InChI=1S/C29H48Cl3NO/c1-18(2)7-6-8-19(3)23-11-12-24-22-10-9-20-17-21(34-26(33)29(30,31)32)13-15-27(20,4)25(22)14-16-28(23,24)5/h18-25,33H,6-17H2,1-5H3/t19?,20?,21-,22?,23?,24?,25?,27?,28?/m0/s1
InChIKey DLBZNTLSHAAHHR-OVPJGOJDSA-N
Molecular Weight 533.068 g/mol
SMILES N=C(C(Cl)(Cl)Cl)O[C@]1(CCC2(C3CCC4(C(C3CCC2C1)CCC4C(CCCC(C)C)C)C)C)[H]
SPLASH splash10-00xr-0769000000-33ee823a40cef5479a13
Source of Spectrum F-52-11171-10
Wiley ID 798255