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HDMP-28 isomer-1 PFP
SpectraBase Compound ID CSJs2D5d5Sn
InChI InChI=1S/C21H20F5NO3/c1-30-18(28)17(15-10-9-13-6-2-3-7-14(13)12-15)16-8-4-5-11-27(16)19(29)20(22,23)21(24,25)26/h2-3,6-7,9-10,12,16-17H,4-5,8,11H2,1H3
InChIKey WXWTUVOGYRCSAQ-UHFFFAOYSA-N
Mol Weight 429.39 g/mol
Molecular Formula C21H20F5NO3
Exact Mass 429.136334 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 5WJs01hHcZD
Name HDMP-28 isomer-2 PFP
Classification Designer drug
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Exact Mass 429.136334320 u
Formula C21H20NO3F5
InChI InChI=1S/C21H20F5NO3/c1-30-18(28)17(15-10-9-13-6-2-3-7-14(13)12-15)16-8-4-5-11-27(16)19(29)20(22,23)21(24,25)26/h2-3,6-7,9-10,12,16-17H,4-5,8,11H2,1H3
InChIKey WXWTUVOGYRCSAQ-UHFFFAOYSA-N
Ionization Type Electron Ionization (EI)
Molecular Weight 429.387 g/mol
SMILES c1ccc2ccc(cc2c1)C(C1CCCCN1C(=O)C(F)(F)C(F)(F)F)C(OC)=O
SPLASH splash10-001i-0390000000-3accc1140c6898197c48
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 Methylnaphthidate isomer-2 PFP
Technique GC/MS
Wiley ID MMPW6e_9472