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5-Bromo UR-144

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5-Bromo UR-144
SpectraBase Compound ID 6onlX9FrBZX
InChI InChI=1S/C21H28BrNO/c1-20(2)19(21(20,3)4)18(24)16-14-23(13-9-5-8-12-22)17-11-7-6-10-15(16)17/h6-7,10-11,14,19H,5,8-9,12-13H2,1-4H3
InChIKey HEWSXAZQMCDEMO-UHFFFAOYSA-N
Mol Weight 390.37 g/mol
Molecular Formula C21H28BrNO
Exact Mass 389.135428 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 3qxDE67wf2
Name UR-144 N-(5-bromopentyl) isomer
Catalog Number 12003
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C21H28BrNO
InChI InChI=1S/C21H28BrNO/c1-20(2)19(21(20,3)4)18(24)16-14-23(13-9-5-8-12-22)17-11-7-6-10-15(16)17/h6-7,10-11,14,19H,5,8-9,12-13H2,1-4H3
InChIKey HEWSXAZQMCDEMO-UHFFFAOYSA-N
Molecular Weight 390.365 g/mol
SMILES C(C1C(C1(C)C)(C)C)(=O)c1c[n](c2c1cccc2)CCCCCBr
SPLASH splash10-0006-2893000000-ac83f5934e3568dfebf3
Source of Spectrum CAY-2023-1797-0
Wiley ID 1889733