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Benzo[g]pyridazino[1,2-b]phthalazine-6,13-dione, 2-bromo-1-ethoxy-1,2,3,4-tetrahydro-2,3-dimethyl-, (1.alpha.,2.beta.,3.beta.)-
SpectraBase Compound ID IxGI0w02p3d
InChI InChI=1S/C20H21BrN2O3/c1-4-26-19-20(3,21)12(2)11-22-17(24)15-9-13-7-5-6-8-14(13)10-16(15)18(25)23(19)22/h5-10,12,19H,4,11H2,1-3H3/t12-,19+,20+/m1/s1
InChIKey OIVYRISNFUZDOE-CFGAKRJMSA-N
Mol Weight 417.3 g/mol
Molecular Formula C20H21BrN2O3
Exact Mass 416.073556 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID KKpAOdJFkbB
Name Benzo[g]pyridazino[1,2-b]phthalazine-6,13-dione, 2-bromo-1-ethoxy-1,2,3,4-tetrahydro-2,3-dimethyl-, (1.alpha.,2.beta.,3.beta.)-
CAS Registry Number 76070-49-0
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C20H21BrN2O3
InChI InChI=1S/C20H21BrN2O3/c1-4-26-19-20(3,21)12(2)11-22-17(24)15-9-13-7-5-6-8-14(13)10-16(15)18(25)23(19)22/h5-10,12,19H,4,11H2,1-3H3/t12-,19+,20+/m1/s1
InChIKey OIVYRISNFUZDOE-CFGAKRJMSA-N
Molecular Weight 417.303 g/mol
SMILES C1(N2N(C(c3c1cc1c(c3)cccc1)=O)[C@]([C@]([C@@](C2)(C)[H])(Br)C)(OCC)[H])=O
SPLASH splash10-004i-0492000000-a91dafcd0823d79de6d3
Source of Spectrum Y-17-1269-0
Synonyms (1S,2S,3R)-2-bromo-1-ethoxy-2,3-dimethyl-1,2,3,4-tetrahydrobenzo[g]pyridazino[1,2-b]phthalazine-6,13-dione 1-Ethoxy-2-bromo-2,3-dimethyl-4a,12a-diaza-1,2,3,4,4a,12,12a-octahydronapthacene-5,12-dione
Wiley ID 1376239