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6-Amino-11-hydroxy-7-methoxy-2,3-dimethyl-1,4,4a,12a-tetrahydronaphthacene-5,12-dione
SpectraBase Compound ID FeE4pJDHzGQ
InChI InChI=1S/C21H21NO4/c1-9-7-12-13(8-10(9)2)21(25)17-16(20(12)24)18(22)15-11(19(17)23)5-4-6-14(15)26-3/h4-6,12-13,23H,7-8,22H2,1-3H3
InChIKey WOKBBTBWIHIVAI-UHFFFAOYSA-N
Mol Weight 351.4 g/mol
Molecular Formula C21H21NO4
Exact Mass 351.147058 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 8xACY0hYG2b
Name 6-Amino-11-hydroxy-7-methoxy-2,3-dimethyl-1,4,4a,12a-tetrahydronaphthacene-5,12-dione
Comments Less than 3 mono-isotopic peaks
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C21H21NO4
InChI InChI=1S/C21H21NO4/c1-9-7-12-13(8-10(9)2)21(25)17-16(20(12)24)18(22)15-11(19(17)23)5-4-6-14(15)26-3/h4-6,12-13,23H,7-8,22H2,1-3H3
InChIKey WOKBBTBWIHIVAI-UHFFFAOYSA-N
Molecular Weight 351.402 g/mol
SMILES Oc1c2c(c(c3c1cccc3OC)N)C(C1C(C2=O)CC(=C(C1)C)C)=O
SPLASH splash10-0a4i-9002000000-2084f527f0fc0e296e15
Source of Spectrum F-48-8448-16
Wiley ID 1341450