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2-Bromo-7-(Isopropylthio)bicyclo[4.4.1]undeca-1,3,5,7,9-pentaene
SpectraBase Compound ID JmfLHwtnL9n
InChI InChI=1S/C14H15BrS/c1-10(2)16-14-8-4-5-11-9-12(14)6-3-7-13(11)15/h3-8,10H,9H2,1-2H3
InChIKey AWDKZYOTBWXQIN-UHFFFAOYSA-N
Mol Weight 295.24 g/mol
Molecular Formula C14H15BrS
Exact Mass 294.007785 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 654mfZab7vE
Name 2-Bromo-7-(isopropylthio)bicyclo[4.4.1]undeca-1.3,5,7,9-pentaene
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C14H15BrS
InChI InChI=1S/C14H15BrS/c1-10(2)16-14-8-4-5-11-9-12(14)6-3-7-13(11)15/h3-8,10H,9H2,1-2H3
InChIKey AWDKZYOTBWXQIN-UHFFFAOYSA-N
Molecular Weight 295.238 g/mol
SMILES C12=C(C=CC=C(C(=CC=C2)SC(C)C)C1)Br
SPLASH splash10-0g4i-0490000000-4e1be90e9e414b450532
Source of Spectrum H-80-135-7a
Synonyms (7-bromobicyclo[4.4.1]undeca-1(10),2,4,6,8-pentaen-2-yl)(isopropyl)sulfane
Wiley ID 1785274