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N-[3-(5-bromanyl-3-nitro-1,2,4-triazol-1-yl)-1-adamantyl]ethanamide
SpectraBase Compound ID Hy4gJfJxMWV
InChI InChI=1S/C14H18BrN5O3/c1-8(21)17-13-3-9-2-10(4-13)6-14(5-9,7-13)19-11(15)16-12(18-19)20(22)23/h9-10H,2-7H2,1H3,(H,17,21)/t9-,10+,13+,14-
InChIKey UYOFRXLJSPAUSD-DHPDLVEQSA-N
Mol Weight 384.23 g/mol
Molecular Formula C14H18BrN5O3
Exact Mass 383.059302 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID KAqdjUaImfN
Name N-[3-(5-bromanyl-3-nitro-1,2,4-triazol-1-yl)-1-adamantyl]ethanamide
Alternate Name(s) N-[3-(5-bromo-3-nitro-1,2,4-triazol-1-yl)-1-adamantyl]acetamide
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C14H18BrN5O3
InChI InChI=1S/C14H18BrN5O3/c1-8(21)17-13-3-9-2-10(4-13)6-14(5-9,7-13)19-11(15)16-12(18-19)20(22)23/h9-10H,2-7H2,1H3,(H,17,21)/t9-,10+,13+,14-
InChIKey UYOFRXLJSPAUSD-DHPDLVEQSA-N
Molecular Weight 384.234 g/mol
SMILES N([C@]12C[C@]3([n]4nc(nc4Br)N(=O)=O)C[C@](C1)(C[C@@](C3)(C2)[H])[H])C(=O)C
SPLASH splash10-0006-5901000000-529a3396481099c73abb
Wiley ID 1443269