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25I-NBOMe-M (HO-) 2AC
SpectraBase Compound ID IxDTYi2VOpn
InChI InChI=1S/C22H26INO6/c1-14(25)24(9-8-16-10-22(29-5)19(23)12-21(16)28-4)13-17-6-7-18(30-15(2)26)11-20(17)27-3/h6-7,10-12H,8-9,13H2,1-5H3
InChIKey JMELOIKJCSKIEL-UHFFFAOYSA-N
Mol Weight 527.36 g/mol
Molecular Formula C22H26INO6
Exact Mass 527.080483 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 9y6jztn1Xw2
Name 25I-NBOMe-M (HO-) 2AC
Classification Designer drug
Comments Structure comment: Wiggly bond = unknown position of substituent
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Exact Mass 527.080482555 u
Formula C22H26NO6I
InChI InChI=1S/C22H26INO6/c1-14(25)24(9-8-16-10-22(29-5)19(23)12-21(16)28-4)13-17-6-7-18(30-15(2)26)11-20(17)27-3/h6-7,10-12H,8-9,13H2,1-5H3
InChIKey JMELOIKJCSKIEL-UHFFFAOYSA-N
Ionization Type Electron Ionization (EI)
Molecular Weight 527.355 g/mol
SMILES c1(cc(c(cc1OC)I)OC)CCN(Cc1c(cc(cc1)OC(=O)C)OC)C(=O)C
SPLASH splash10-0a70-2940000000-a48955d4e00c19d52d1f
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 25I-NB2OMe-M (HO-) 2AC
Technique GC/MS
Wiley ID MMPW6e_9394