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5H-1,2,4-Triazolo[4,3-a]azepine, 3-[(4-bromophenoxy)methyl]-6,7,8,9-tetrahydro-
SpectraBase Compound ID 4ZtYt3KyQlU
InChI InChI=1S/C14H16BrN3O/c15-11-5-7-12(8-6-11)19-10-14-17-16-13-4-2-1-3-9-18(13)14/h5-8H,1-4,9-10H2
InChIKey XMIXCUZQEXANIC-UHFFFAOYSA-N
Mol Weight 322.21 g/mol
Molecular Formula C14H16BrN3O
Exact Mass 321.047675 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID L2928Wcjknn
Name 5H-1,2,4-Triazolo[4,3-a]azepine, 3-[(4-bromophenoxy)methyl]-6,7,8,9-tetrahydro-
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C14H16BrN3O
InChI InChI=1S/C14H16BrN3O/c15-11-5-7-12(8-6-11)19-10-14-17-16-13-4-2-1-3-9-18(13)14/h5-8H,1-4,9-10H2
InChIKey XMIXCUZQEXANIC-UHFFFAOYSA-N
Molecular Weight 322.206 g/mol
SMILES C1CC[n]2c(nnc2CC1)COc1ccc(cc1)Br
SPLASH splash10-0udm-9800000000-e65dd4eb635bc00318ef
Source of Spectrum IY-1-4288-5
Synonyms 3-[(4-bromophenoxy)methyl]-6,7,8,9-tetrahydro-5H-[1,2,4]triazolo[4,3-a]azepine 3-[(4-bromanylphenoxy)methyl]-6,7,8,9-tetrahydro-5H-[1,2,4]triazolo[4,3-a]azepine
Wiley ID 1650876