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Azepan-1-yl(3-bromophenyl)methanone
SpectraBase Compound ID IoAfL9fS08f
InChI InChI=1S/C13H16BrNO/c14-12-7-5-6-11(10-12)13(16)15-8-3-1-2-4-9-15/h5-7,10H,1-4,8-9H2
InChIKey BUZMAZIUXRIQMD-UHFFFAOYSA-N
Mol Weight 282.18 g/mol
Molecular Formula C13H16BrNO
Exact Mass 281.041527 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 4nghq0EYC0k
Name Azepan-1-yl(3-bromophenyl)methanone
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 281.041527138 u
Formula C13H16BrNO
InChI InChI=1S/C13H16BrNO/c14-12-7-5-6-11(10-12)13(16)15-8-3-1-2-4-9-15/h5-7,10H,1-4,8-9H2
InChIKey BUZMAZIUXRIQMD-UHFFFAOYSA-N
Ionization Type EI
Literature Reference DOI 10.1002/chem.201500779
Quality 36
Reported Formula C13H16BrNO
SMILES C1N(CCCCC1)C(=O)C1=CC(=CC=C1)Br
SPLASH splash10-001i-0980000000-d1a447fedd705b2196c1
Source of Spectrum QE-21-SM7-3v (DOI: 10.1002/chem.201500779)
Wiley ID 1906493