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Tapentadol

View entire compound with spectra: 6 MS (GC)

Tapentadol
SpectraBase Compound ID KrT1khWAz6z
InChI InChI=1S/C14H23NO/c1-5-14(11(2)10-15(3)4)12-7-6-8-13(16)9-12/h6-9,11,14,16H,5,10H2,1-4H3/t11-,14+/m0/s1
InChIKey KWTWDQCKEHXFFR-SMDDNHRTSA-N
Mol Weight 221.34 g/mol
Molecular Formula C14H23NO
Exact Mass 221.177964 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 5dgi6jFIqkL
Name Tapentadol
Catalog Number 9000620
CAS Registry Number 175591-09-0
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C14H23NO
InChI InChI=1S/C14H23NO/c1-5-14(11(2)10-15(3)4)12-7-6-8-13(16)9-12/h6-9,11,14,16H,5,10H2,1-4H3/t11-,14+/m0/s1
InChIKey KWTWDQCKEHXFFR-SMDDNHRTSA-N
Molecular Weight 221.344 g/mol
SMILES Oc1cccc(c1)[C@@]([C@](CN(C)C)(C)[H])(CC)[H]
SPLASH splash10-0a4i-9200000000-8ef29928c5f2898d5f7b
Source of Spectrum CAY-2023-1191-0
Wiley ID 1889144