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Preocoteine
SpectraBase Compound ID AUGoT1SF87u
InChI InChI=1S/C21H25NO5/c1-22-7-6-12-17-14(22)8-11-9-15(24-2)16(25-3)10-13(11)18(17)19(23)21(27-5)20(12)26-4/h9-10,14,23H,6-8H2,1-5H3
InChIKey XTOKXEQMTBIOGT-UHFFFAOYSA-N
Mol Weight 371.43 g/mol
Molecular Formula C21H25NO5
Exact Mass 371.173273 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID I8kDgfEGHCI
Name Preocoteine
Alternate Name(s) (+-)-Preocoteine 2,3,9,10-Tetramethoxy-6-methyl-5,6,6a,7-tetrahydro-4H-dibenzo[de,g]quinolin-1-ol
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C21H25NO5
InChI InChI=1S/C21H25NO5/c1-22-7-6-12-17-14(22)8-11-9-15(24-2)16(25-3)10-13(11)18(17)19(23)21(27-5)20(12)26-4/h9-10,14,23H,6-8H2,1-5H3
InChIKey XTOKXEQMTBIOGT-UHFFFAOYSA-N
Molecular Weight 371.433 g/mol
SMILES Oc1c-2c3c(CCN(C3Cc3c2cc(c(OC)c3)OC)C)c(c1OC)OC
SPLASH splash10-00di-0009000000-2ec9b6c0c95a9f84092e
Source of Spectrum E1-57-375-1b
Wiley ID 1661709