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3-Bromomethylheptane
SpectraBase Compound ID Es2mpgdRV8t
InChI InChI=1S/C8H17Br/c1-3-5-6-8(4-2)7-9/h8H,3-7H2,1-2H3
InChIKey NZWIYPLSXWYKLH-UHFFFAOYSA-N
Mol Weight 193.13 g/mol
Molecular Formula C8H17Br
Exact Mass 192.051364 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 893f9xdC5tc
Name Heptane, 3-(bromomethyl)-
Alternate Name(s) 1-Bromo-2-ethylhexane 2-Ethylhexyl bromide EINECS 242-659-9
CAS Registry Number 18908-66-2
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C8H17Br
InChI InChI=1S/C8H17Br/c1-3-5-6-8(4-2)7-9/h8H,3-7H2,1-2H3
InChIKey NZWIYPLSXWYKLH-UHFFFAOYSA-N
Molecular Weight 193.128 g/mol
SMILES CCCCC(CC)CBr
SPLASH splash10-0a4l-9000000000-c22434cb6a23566c2c3e
Source of Spectrum NW-1971-0-0
Wiley ID 1188018