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N-Methyl-U-47931E
SpectraBase Compound ID Coz4i6kSeb6
InChI InChI=1S/C16H23BrN2O/c1-18(2)14-6-4-5-7-15(14)19(3)16(20)12-8-10-13(17)11-9-12/h8-11,14-15H,4-7H2,1-3H3/t14-,15-/m1/s1
InChIKey XQCGUPNNNXRBDG-HUUCEWRRSA-N
Mol Weight 339.28 g/mol
Molecular Formula C16H23BrN2O
Exact Mass 338.099376 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 4EcAbVs8a8
Name N-methyl U-47931E
Catalog Number 24286
CAS Registry Number 75570-38-6
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C16H23BrN2O
InChI InChI=1S/C16H23BrN2O/c1-18(2)14-6-4-5-7-15(14)19(3)16(20)12-8-10-13(17)11-9-12/h8-11,14-15H,4-7H2,1-3H3/t14-,15-/m1/s1
InChIKey XQCGUPNNNXRBDG-HUUCEWRRSA-N
Molecular Weight 339.277 g/mol
SMILES c1c(Br)ccc(C(N([C@@]2(CCCC[C@]2(N(C)C)[H])[H])C)=O)c1
SPLASH splash10-003r-9700000000-5670c18cd0a8ead690ae
Source of Spectrum CAY-2023-692-0
Wiley ID 1888651