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N-[2,6-dihydroxy-3,5-dimethoxyphenanthren-8-ylethyl]-N,N,N-(trimethyl)amine salt
SpectraBase Compound ID HUuYulvRD4e
InChI InChI=1S/C21H25NO4/c1-22(2,3)9-8-14-11-18(24)21(26-5)20-15(14)7-6-13-10-17(23)19(25-4)12-16(13)20/h6-7,10-12H,8-9H2,1-5H3,(H-,23,24)/p+1
InChIKey JLJBNEOBBNCXLG-UHFFFAOYSA-O
Mol Weight 356.44 g/mol
Molecular Formula C21H26NO4
Exact Mass 356.186183 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 6Aj2rTzHIsI
Name N-[2,6-dihydroxy-3,5-dimethoxyphenanthren-8-ylethyl]-N,N,N-(trimethyl)amine salt
Alternate Name(s) 2-(3,7-dihydroxy-4,6-dimethoxy-1-phenanthrenyl)ethyl-trimethylammonium 2-(3,7-dihydroxy-4,6-dimethoxyphenanthren-1-yl)ethyl-trimethylazanium 2-[4,6-dimethoxy-3,7-bis(oxidanyl)phenanthren-1-yl]ethyl-trimethyl-azanium
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Formula C21H26NO4
InChI InChI=1S/C21H25NO4/c1-22(2,3)9-8-14-11-18(24)21(26-5)20-15(14)7-6-13-10-17(23)19(25-4)12-16(13)20/h6-7,10-12H,8-9H2,1-5H3,(H-,23,24)/p+1
InChIKey JLJBNEOBBNCXLG-UHFFFAOYSA-O
Molecular Weight 356.442 g/mol
SMILES Oc1cc(c2c(c3c(cc(c(c3)OC)O)cc2)c1OC)CC[N+](C)(C)C
SPLASH splash10-00lr-2091000000-92ad6e8a5bc164b308e7
Source of Spectrum E2-52-697-2
Wiley ID 1556471