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Catalog | BBC128397411 |
CAS | 128397-41-1 |
IUPAC Name | 13-Methyl-5,7,17,19-tetraoxa-13-azoniahexacyclo[11.11.0.02,10.04,8.015,23.016,20]tetracosa-2,4(8),9,15(23),16(20),21-hexaen-1-ol |
Molecular Weight | 354.38 |
Molecular Formula | C20H20NO5 |
Canonical SMILES | C[N+]12CCC3=CC4=C(C=C3C1(CC5=C(C2)C6=C(C=C5)OCO6)O)OCO4 |
InChI | InChI=1S/C20H20NO5/c1-21-5-4-12-6-17-18(25-10-24-17)7-15(12)20(21,22)8-13-2-3-16-19(14(13)9-21)26-11-23-16/h2-3,6-7,22H,4-5,8-11H2,1H3/q+1 |
InChI Key | SZMZXQWCICMUFH-UHFFFAOYSA-N |
Melting Point | 151-152 °C |
Purity | 98% |
Appearance | Powder |
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