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1,5-dibromo-3-(cyclopropylidenemethyl)-2-oct-2-ynoxy-benzene
SpectraBase Compound ID ERDse3SVdNA
InChI InChI=1S/C18H20Br2O/c1-2-3-4-5-6-7-10-21-18-15(11-14-8-9-14)12-16(19)13-17(18)20/h11-13H,2-5,8-10H2,1H3
InChIKey LWSICJFJROEGDA-UHFFFAOYSA-N
Mol Weight 412.17 g/mol
Molecular Formula C18H20Br2O
Exact Mass 409.988091 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID IBT2R5m4fEF
Name 1,5-dibromo-3-(cyclopropylidenemethyl)-2-oct-2-ynoxy-benzene
Appearance White solid
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C18H20Br2O
InChI InChI=1S/C18H20Br2O/c1-2-3-4-5-6-7-10-21-18-15(11-14-8-9-14)12-16(19)13-17(18)20/h11-13H,2-5,8-10H2,1H3
InChIKey LWSICJFJROEGDA-UHFFFAOYSA-N
Ionization Type EI
Literature Reference DOI 10.1002/chem.201700600
Molecular Weight 412.165 g/mol
Quality 8
Reported Formula C18H20OBr2
SMILES C1=C(C=C(C(=C1C=C1CC1)OCC#CCCCCC)Br)Br
SPLASH splash10-014i-0900000000-e9e2fb640a0e8b0a326d
Source of Spectrum QE-23-SM48-3k (DOI: 10.1002/chem.201700600)
Wiley ID 1905491