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2-(5-Bromo-2-(piperidin-1-yl)phenyl)-4,4-dimethyl-4,5-dihydrooxazole
SpectraBase Compound ID JtpK6lnkRcy
InChI InChI=1S/C16H21BrN2O/c1-16(2)11-20-15(18-16)13-10-12(17)6-7-14(13)19-8-4-3-5-9-19/h6-7,10H,3-5,8-9,11H2,1-2H3
InChIKey QVVIYTBJMKKMOP-UHFFFAOYSA-N
Mol Weight 337.26 g/mol
Molecular Formula C16H21BrN2O
Exact Mass 336.083726 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 3ximfv3fjf1
Name 2-(5-Bromo-2-(piperidin-1-yl)phenyl)-4,4-dimethyl-4,5-dihydrooxazole
Appearance White solid
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Exact Mass 336.083726303 u
Formula C16H21BrN2O
InChI InChI=1S/C16H21BrN2O/c1-16(2)11-20-15(18-16)13-10-12(17)6-7-14(13)19-8-4-3-5-9-19/h6-7,10H,3-5,8-9,11H2,1-2H3
InChIKey QVVIYTBJMKKMOP-UHFFFAOYSA-N
Instrument Name FINNIGAN MAT 95Q or HEWLETT-PACKARD HP 6890-MSD 5973
Ionization Type EI
Literature Reference DOI 10.1002/chem.202103700
Molecular Weight 337.261 g/mol
Quality 100
Reported Formula C16H21BrN2O
SMILES C1(=NC(CO1)(C)C)C1=C(C=CC(=C1)Br)N1CCCCC1
SPLASH splash10-00c0-0191000000-aa3602b7a04b971823c8
Source of Spectrum QE-28-SM83-8c (DOI: 10.1002/chem.202103700)
Wiley ID 1898257