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25C-NBOMe TFA
SpectraBase Compound ID 2Nl1UkWynon
InChI InChI=1S/C20H21ClF3NO4/c1-27-16-7-5-4-6-14(16)12-25(19(26)20(22,23)24)9-8-13-10-18(29-3)15(21)11-17(13)28-2/h4-7,10-11H,8-9,12H2,1-3H3
InChIKey BORKBXMJFDJENI-UHFFFAOYSA-N
Mol Weight 431.84 g/mol
Molecular Formula C20H21ClF3NO4
Exact Mass 431.11112 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID CR1HNYwFTuj
Name 25C-NBOMe TFA
Classification Designer drug
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Exact Mass 431.111120345 u
Formula C20H21NO4ClF3
InChI InChI=1S/C20H21ClF3NO4/c1-27-16-7-5-4-6-14(16)12-25(19(26)20(22,23)24)9-8-13-10-18(29-3)15(21)11-17(13)28-2/h4-7,10-11H,8-9,12H2,1-3H3
InChIKey BORKBXMJFDJENI-UHFFFAOYSA-N
Ionization Type Electron Ionization (EI)
Molecular Weight 431.839 g/mol
SMILES c1(CN(CCc2cc(OC)c(Cl)cc2OC)C(C(F)(F)F)=O)c(OC)cccc1
SPLASH splash10-0002-2910000000-a7d3b2d17b9f6e6b20c5
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_10316