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MBDB-M (demethylenylmethyl-) 2TFA
SpectraBase Compound ID I4hTOtoGWiy
InChI InChI=1S/C16H17F6NO4/c1-4-10(23(2)13(24)15(17,18)19)7-9-5-6-11(12(8-9)26-3)27-14(25)16(20,21)22/h5-6,8,10H,4,7H2,1-3H3
InChIKey JHLNHMLRNPOVFY-UHFFFAOYSA-N
Mol Weight 401.31 g/mol
Molecular Formula C16H17F6NO4
Exact Mass 401.106177 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID EQEz5i326ne
Name MBDB-M (demethylenylmethyl-) 2TFA
Classification Psychedelic Designer drug
Copyright Copyright © 2023-2024 Wiley-VCH GmbH. All Rights Reserved.
Exact Mass 401.106177005 u
Formula C16H17NO4F6
InChI InChI=1S/C16H17F6NO4/c1-4-10(23(2)13(24)15(17,18)19)7-9-5-6-11(12(8-9)26-3)27-14(25)16(20,21)22/h5-6,8,10H,4,7H2,1-3H3
InChIKey JHLNHMLRNPOVFY-UHFFFAOYSA-N
Ionization Type Electron Ionization (EI)
Molecular Weight 401.305 g/mol
SMILES c1cc(cc(c1OC(=O)C(F)(F)F)OC)CC(CC)N(C)C(=O)C(F)(F)F
SPLASH splash10-014i-7910000000-4b95daddb972137de3ed
Sample Comments The MMPW Reference Handbook and associated Tables are attached to Record #1, under the Attachments tab. Refer to these references for an explanation of the Sample Preparation Procedure "Detected" abbreviations, as well as other relevant information pertaining to this database.
Source of Spectrum H.H.Maurer, M.Meyer, K.Pfleger, A.A. Weber / University of Saarland, D-66424 Homburg Germany
Synonyms MBDB-M (demethylenyl-methyl-) 2TFA
Technique GC/MS
Wiley ID MMPW6e_8487