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5MT-NB4B 2HFB
SpectraBase Compound ID 1yFS6bldez3
InChI InChI=1S/C26H17BrF14N2O3/c1-46-16-6-7-18-17(10-16)14(12-43(18)20(45)22(30,31)24(34,35)26(39,40)41)8-9-42(11-13-2-4-15(27)5-3-13)19(44)21(28,29)23(32,33)25(36,37)38/h2-7,10,12H,8-9,11H2,1H3
InChIKey JVIHLTMFFMXPDG-UHFFFAOYSA-N
Mol Weight 751.31 g/mol
Molecular Formula C26H17BrF14N2O3
Exact Mass 750.0199 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID Gy275qIv5PX
Name 5MT-NB4B 2HFB
Classification Designer drug
Copyright Copyright © 2023-2024 Wiley-VCH GmbH. All Rights Reserved.
Exact Mass 750.019899694 u
Formula C26H17N2O3BrF14
InChI InChI=1S/C26H17BrF14N2O3/c1-46-16-6-7-18-17(10-16)14(12-43(18)20(45)22(30,31)24(34,35)26(39,40)41)8-9-42(11-13-2-4-15(27)5-3-13)19(44)21(28,29)23(32,33)25(36,37)38/h2-7,10,12H,8-9,11H2,1H3
InChIKey JVIHLTMFFMXPDG-UHFFFAOYSA-N
Ionization Type Electron Ionization (EI)
Molecular Weight 751.315 g/mol
SMILES c1(ccc2c(c1)c(c[n]2C(=O)C(F)(F)C(F)(F)C(F)(F)F)CCN(C(=O)C(F)(F)C(F)(F)C(F)(F)F)Cc1ccc(cc1)Br)OC
SPLASH splash10-06di-1709000000-6157b4515afdb89ea001
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_9916