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4-Bromoheptane
SpectraBase Compound ID 41n1mqfmDeT
InChI InChI=1S/C7H15Br/c1-3-5-7(8)6-4-2/h7H,3-6H2,1-2H3
InChIKey BNUTXEKPXPZAIT-UHFFFAOYSA-N
Mol Weight 179.1 g/mol
Molecular Formula C7H15Br
Exact Mass 178.035713 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID KkWaXaODIUv
Name 4-Bromoheptane
CAS Registry Number 998-93-6
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C7H15Br
InChI InChI=1S/C7H15Br/c1-3-5-7(8)6-4-2/h7H,3-6H2,1-2H3
InChIKey BNUTXEKPXPZAIT-UHFFFAOYSA-N
Molecular Weight 179.101 g/mol
SMILES CCCC(Br)CCC
SPLASH splash10-0a4l-9000000000-0f6cfb20e12f66813e00
Source of Spectrum NP-2-8464-0
Synonyms 4-Bromanylheptane Heptane, 4-bromo-
Wiley ID 1101790