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Estra-1(10),2,4-triene-3,17-diol, 4-amino-
SpectraBase Compound ID IoGpeWlUaiN
InChI InChI=1S/C18H25NO2/c1-18-9-8-11-10-4-6-15(20)17(19)13(10)3-2-12(11)14(18)5-7-16(18)21/h4,6,11-12,14,16,20-21H,2-3,5,7-9,19H2,1H3
InChIKey DIDANTCTDBQPRP-UHFFFAOYSA-N
Mol Weight 287.4 g/mol
Molecular Formula C18H25NO2
Exact Mass 287.188529 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID AzmW0Tp43to
Name Estra-1(10),2,4-triene-3,17-diol, 4-amino-
Alternate Name(s) 4-Amino-13-methyl-7,8,9,11,12,13,14,15,16,17-decahydro-6H-cyclopenta[a]phenanthrene-3,17-diol 4-Aminoestra-1(10),2,4-triene-3,17-diol 4-Azanyl-13-methyl-6,7,8,9,11,12,14,15,16,17-decahydrocyclopenta[a]phenanthrene-3,17-diol
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Formula C18H25NO2
InChI InChI=1S/C18H25NO2/c1-18-9-8-11-10-4-6-15(20)17(19)13(10)3-2-12(11)14(18)5-7-16(18)21/h4,6,11-12,14,16,20-21H,2-3,5,7-9,19H2,1H3
InChIKey DIDANTCTDBQPRP-UHFFFAOYSA-N
Molecular Weight 287.403 g/mol
SMILES Nc1c(ccc2C3C(CCc12)C1C(CC3)(C)C(CC1)O)O
SPLASH splash10-000i-2790000000-493809489cb6dcfe5475
Source of Spectrum JX-2015-2-1171
Wiley ID 1722834