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3-Benzyl-2-methylbenzo[d]oxazol-3-iumbromide
SpectraBase Compound ID 2CzMgUSpRjj
InChI InChI=1S/C15H14NO.BrH/c1-12-16(11-13-7-3-2-4-8-13)14-9-5-6-10-15(14)17-12;/h2-10H,11H2,1H3;1H/q+1;/p-1
InChIKey IKJTUTACXVLJOX-UHFFFAOYSA-M
Mol Weight 304.19 g/mol
Molecular Formula C15H14BrNO
Exact Mass 303.025877 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID J2Zc0bh14S6
Name 3-Benzyl-2-methylbenzo[d]oxazol-3-iumbromide
Appearance Colorless solid
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 303.025877074 u
Formula C15H14BrNO
InChI InChI=1S/C15H14NO.BrH/c1-12-16(11-13-7-3-2-4-8-13)14-9-5-6-10-15(14)17-12;/h2-10H,11H2,1H3;1H/q+1;/p-1
InChIKey IKJTUTACXVLJOX-UHFFFAOYSA-M
Instrument Name Finnigan MAT TSQ 7000
Ionization Type EI positive ion
Literature Reference DOI 10.1002/chem.202202579
Molecular Weight 304.187 g/mol
Quality 121
SMILES [Br-].C1=CC2=C(C=C1)[N+](=C(O2)C)CC1=CC=CC=C1
SPLASH splash10-006x-9160000000-9d538422421e1c884cbc
Source of Spectrum QE-28-SM58-2ac (DOI: 10.1002/chem.202202579)
Thin-Layer Chromatography 0.10 (n-hexane/acetone, 1:1)
Wiley ID 1900728