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MBDB-M (demethylenyl-methyl-) 2HFB
SpectraBase Compound ID 9E8kV6jGGLV
InChI InChI=1S/C20H17F14NO4/c1-4-10(35(2)13(36)15(21,22)17(25,26)19(29,30)31)7-9-5-6-11(12(8-9)38-3)39-14(37)16(23,24)18(27,28)20(32,33)34/h5-6,8,10H,4,7H2,1-3H3
InChIKey NNGPIPISKQRCPO-UHFFFAOYSA-N
Mol Weight 601.34 g/mol
Molecular Formula C20H17F14NO4
Exact Mass 601.093402 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID HjdOGT4kyq1
Name MBDB-M (demethylenyl-methyl-) 2HFB
Classification Psychedelic Designer drug
Copyright Copyright © 2023-2024 Wiley-VCH GmbH. All Rights Reserved.
Exact Mass 601.093402309 u
Formula C20H17NO4F14
InChI InChI=1S/C20H17F14NO4/c1-4-10(35(2)13(36)15(21,22)17(25,26)19(29,30)31)7-9-5-6-11(12(8-9)38-3)39-14(37)16(23,24)18(27,28)20(32,33)34/h5-6,8,10H,4,7H2,1-3H3
InChIKey NNGPIPISKQRCPO-UHFFFAOYSA-N
Ionization Type Electron Ionization (EI)
Molecular Weight 601.337 g/mol
SMILES c1cc(cc(c1OC(=O)C(F)(F)C(F)(F)C(F)(F)F)OC)CC(CC)N(C)C(C(C(F)(F)C(F)(F)F)(F)F)=O
SPLASH splash10-014i-9541000000-c2b37179653411202d2a
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
Technique GC/MS
Wiley ID MMPW6e_8491