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Thaliporphinemethine
SpectraBase Compound ID DE205kQOgvh
InChI InChI=1S/C21H25NO4/c1-22(2)9-8-14-11-19(26-5)21(23)20-15(14)7-6-13-10-17(24-3)18(25-4)12-16(13)20/h6-7,10-12,23H,8-9H2,1-5H3
InChIKey HVZVJBZDWBORKU-UHFFFAOYSA-N
Mol Weight 355.43 g/mol
Molecular Formula C21H25NO4
Exact Mass 355.178358 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 55xWYLcx1xN
Name Thaliporphinemethine
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C21H25NO4
InChI InChI=1S/C21H25NO4/c1-22(2)9-8-14-11-19(26-5)21(23)20-15(14)7-6-13-10-17(24-3)18(25-4)12-16(13)20/h6-7,10-12,23H,8-9H2,1-5H3
InChIKey HVZVJBZDWBORKU-UHFFFAOYSA-N
Molecular Weight 355.434 g/mol
SMILES Oc1c2c3cc(OC)c(cc3ccc2c(CCN(C)C)cc1OC)OC
SPLASH splash10-0a4i-9000000000-f9386773262d9f372fbd
Source of Spectrum X2-51-439-485
Synonyms Thaliporphine-methine 1-[2-(dimethylamino)ethyl]-3,6,7-trimethoxy-4-phenanthrenol 1-[2-(dimethylamino)ethyl]-3,6,7-trimethoxyphenanthren-4-ol
Wiley ID 1602690