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Benzo[g]pyridazino[1,2-b]phthalazine-6,13-dione, 3-(acetyloxy)-2-chloro-1,2,3,4,8,9,10,11-octahydro-2-methyl-, trans-
SpectraBase Compound ID 9BWfM4EnyU4
InChI InChI=1S/C19H21ClN2O4/c1-11(23)26-16-9-21-17(24)14-7-12-5-3-4-6-13(12)8-15(14)18(25)22(21)10-19(16,2)20/h7-8,16H,3-6,9-10H2,1-2H3/t16-,19+/m0/s1
InChIKey HSCOLWYZMMTLMW-QFBILLFUSA-N
Mol Weight 376.84 g/mol
Molecular Formula C19H21ClN2O4
Exact Mass 376.118985 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 2OIVtcwEcqm
Name Benzo[g]pyridazino[1,2-b]phthalazine-6,13-dione, 3-(acetyloxy)-2-chloro-1,2,3,4,8,9,10,11-octahydro-2-methyl-, trans-
CAS Registry Number 113246-76-7
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C19H21ClN2O4
InChI InChI=1S/C19H21ClN2O4/c1-11(23)26-16-9-21-17(24)14-7-12-5-3-4-6-13(12)8-15(14)18(25)22(21)10-19(16,2)20/h7-8,16H,3-6,9-10H2,1-2H3/t16-,19+/m0/s1
InChIKey HSCOLWYZMMTLMW-QFBILLFUSA-N
Molecular Weight 376.840 g/mol
SMILES C1(N2N(C(c3c1cc1c(c3)CCCC1)=O)C[C@]([C@](C2)(OC(=O)C)[H])(Cl)C)=O
SPLASH splash10-001i-3192000000-71bf751ef74089715585
Source of Spectrum Y-24-986-5
Synonyms (2S,3R)-3-chloro-3-methyl-6,13-dioxo-1,2,3,4,6,8,9,10,11,13-decahydrobenzo[g]pyridazino[1,2-b]phthalazin-2-yl acetate 3-Acetoxy-2-chloro-2-methyl-6,13-dioxo-1,2,3,4,6,13-hexahydrobenzo[g]pyridazine[1,2-b]phthalazine
Wiley ID 1357605