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10,11-Dibromo-9-acetoxy-10,11-dihydro-6'-methoxycinchonane
SpectraBase Compound ID LispyM9gCSQ
InChI InChI=1S/C22H24Br2N2O3/c1-13(27)29-22(16-5-7-25-20-4-3-15(28-2)10-17(16)20)21-9-14-6-8-26(21)12-18(14)19(24)11-23/h3-5,7,10-11,14,18,21-22H,6,8-9,12H2,1-2H3/b19-11-
InChIKey LEIYBWJHDPBCBM-ODLFYWEKSA-N
Mol Weight 524.25 g/mol
Molecular Formula C22H24Br2N2O3
Exact Mass 522.015369 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 59eHScg1Rx9
Name 10,11-Dibromo-9-acetoxy-10,11-dihydro-6'-methoxycinchonane
Alternate Name(s) (10Z)-10,11-dibromo-6'-methoxycinchonan-9-yl acetate
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C22H24Br2N2O3
InChI InChI=1S/C22H24Br2N2O3/c1-13(27)29-22(16-5-7-25-20-4-3-15(28-2)10-17(16)20)21-9-14-6-8-26(21)12-18(14)19(24)11-23/h3-5,7,10-11,14,18,21-22H,6,8-9,12H2,1-2H3/b19-11-
InChIKey LEIYBWJHDPBCBM-ODLFYWEKSA-N
Molecular Weight 524.253 g/mol
SMILES C1(N2CCC(C1)C(C2)\C(=C\Br)Br)C(c1c2c(ccc(c2)OC)ncc1)OC(=O)C
SPLASH splash10-05o9-2916000000-2faa9bd74eb774a3ee7a
Source of Spectrum H-83-784-2
Wiley ID 847074