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3-[1'-acetoxy-2'-{[(acetyl)(methyl)amino]methyl}cyclohexyl}-1-hydroxybenzene
SpectraBase Compound ID Lue23riGsvp
InChI InChI=1S/C18H25NO4/c1-13(20)19(3)12-16-7-4-5-10-18(16,23-14(2)21)15-8-6-9-17(22)11-15/h6,8-9,11,16,22H,4-5,7,10,12H2,1-3H3
InChIKey PBRAFBBLMYUOAQ-UHFFFAOYSA-N
Mol Weight 319.4 g/mol
Molecular Formula C18H25NO4
Exact Mass 319.178358 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 4o6F3dS12KC
Name 3-[1'-acetoxy-2'-{[(acetyl)(methyl)amino]methyl}cyclohexyl}-1-hydroxybenzene
Copyright Copyright © 2020-2025 John Wiley & Sons, Inc. All Rights Reserved.
Formula C18H25NO4
InChI InChI=1S/C18H25NO4/c1-13(20)19(3)12-16-7-4-5-10-18(16,23-14(2)21)15-8-6-9-17(22)11-15/h6,8-9,11,16,22H,4-5,7,10,12H2,1-3H3
InChIKey PBRAFBBLMYUOAQ-UHFFFAOYSA-N
Molecular Weight 319.401 g/mol
SMILES Oc1cc(C2(C(CN(C(=O)C)C)CCCC2)OC(=O)C)ccc1
SPLASH splash10-030c-2916000000-24f1931fdc1fa84553fe
Source of Spectrum CJ-0-16-0
Synonyms 2-{[acetyl(methyl)amino]methyl}-1-(3-hydroxyphenyl)cyclohexyl acetate Diacetyl metabolite II from tramadol
Wiley ID 1319409