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2-(4-bromophenyl)-4-propyl-4H-3,1-benzoxazine
SpectraBase Compound ID A4CNIAiBtf1
InChI InChI=1S/C17H16BrNO/c1-2-5-16-14-6-3-4-7-15(14)19-17(20-16)12-8-10-13(18)11-9-12/h3-4,6-11,16H,2,5H2,1H3
InChIKey PBLLWRDBVOJVHW-UHFFFAOYSA-N
Mol Weight 330.23 g/mol
Molecular Formula C17H16BrNO
Exact Mass 329.041527 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 1ubVsurpK4
Name 2-(4-bromophenyl)-4-propyl-4H-3,1-benzoxazine
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C17H16BrNO
InChI InChI=1S/C17H16BrNO/c1-2-5-16-14-6-3-4-7-15(14)19-17(20-16)12-8-10-13(18)11-9-12/h3-4,6-11,16H,2,5H2,1H3
InChIKey PBLLWRDBVOJVHW-UHFFFAOYSA-N
Instrument Name HP 5972
Ionization Type EI
Literature Reference DOI 10.1016/S1044-0305(01)00277-X
Molecular Weight 330.225 g/mol
SMILES c1cc2c(cc1)N=C(OC2CCC)c1ccc(cc1)Br
SPLASH splash10-000i-0090000000-a4cc98da41c069b7382c
Source of Spectrum A7-12-959-17
Wiley ID 1843762