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Ambroxol 3AC
SpectraBase Compound ID FjONWTNMyRK
InChI InChI=1S/C19H24Br2N2O4/c1-11(24)22-19-14(8-15(20)9-18(19)21)10-23(12(2)25)16-4-6-17(7-5-16)27-13(3)26/h8-9,16-17H,4-7,10H2,1-3H3,(H,22,24)
InChIKey NEQMXLVZDNXDQT-UHFFFAOYSA-N
Mol Weight 504.22 g/mol
Molecular Formula C19H24Br2N2O4
Exact Mass 502.010283 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 9tPOneYGSRr
Name 4-(N-(2-acetylamino-3,5-dibromobenzyl)-N-acetylamino)-1-acetoxy-cyclohexane
Alternate Name(s) 4-{acetyl[2-(acetylamino)-3,5-dibromobenzyl]amino}cyclohexyl acetate Acetic acid [4-[(2-acetamido-3,5-dibromophenyl)methyl-acetylamino]cyclohexyl] ester [4-[(2-acetamido-3,5-dibromophenyl)methyl-acetylamino]cyclohexyl] acetate [4-[(2-acetamido-3,5-dibromo-phenyl)methyl-acetyl-amino]cyclohexyl] acetate [4-[[2-acetamido-3,5-bis(bromanyl)phenyl]methyl-ethanoyl-amino]cyclohexyl] ethanoate
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Formula C19H24Br2N2O4
InChI InChI=1S/C19H24Br2N2O4/c1-11(24)22-19-14(8-15(20)9-18(19)21)10-23(12(2)25)16-4-6-17(7-5-16)27-13(3)26/h8-9,16-17H,4-7,10H2,1-3H3,(H,22,24)
InChIKey NEQMXLVZDNXDQT-UHFFFAOYSA-N
Molecular Weight 504.219 g/mol
SMILES N(c1c(CN(C(=O)C)C2CCC(OC(=O)C)CC2)cc(cc1Br)Br)C(=O)C
SPLASH splash10-01si-6090200000-f7cf42519ef8b63fb086
Source of Spectrum CJ-1992-0-0
Wiley ID 1399120