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Tazettine
SpectraBase Compound ID FkcHJ9xoDLM
InChI InChI=1S/C18H21NO5/c1-19-9-18(20)17(4-3-12(21-2)6-16(17)19)13-7-15-14(22-10-23-15)5-11(13)8-24-18/h3-5,7,12,16,20H,6,8-10H2,1-2H3/t12-,16+,17+,18-/m1/s1
InChIKey YLWAQARRNQVEHD-PBZHRCKQSA-N
Mol Weight 331.37 g/mol
Molecular Formula C18H21NO5
Exact Mass 331.141973 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID G2R1oxXgx5y
Name Tazettine
Alternate Name(s) (3S,4aS,6aS,13bS)-3-methoxy-5-methyl-4,4a,5,6-tetrahydro-8H-[1,3]dioxolo[4',5':6,7]isochromeno[3,4-c]indol-6a(3H)-ol
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Formula C18H21NO5
InChI InChI=1S/C18H21NO5/c1-19-9-18(20)17(4-3-12(21-2)6-16(17)19)13-7-15-14(22-10-23-15)5-11(13)8-24-18/h3-5,7,12,16,20H,6,8-10H2,1-2H3/t12-,16+,17+,18-/m1/s1
InChIKey YLWAQARRNQVEHD-PBZHRCKQSA-N
Molecular Weight 331.368 g/mol
SMILES O[C@]12OCc3c(cc4OCOc4c3)[C@@]11[C@@](N(C2)C)(C[C@@](C=C1)(OC)[H])[H]
SPLASH splash10-0002-0092000000-76f01db4d4113704b275
Source of Spectrum PA-19-415-24
Wiley ID 1789577