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5-Bromo-[2.2]metacyclophane
SpectraBase Compound ID 8Tm7sRDBOxO
InChI InChI=1S/C16H15Br/c17-16-10-14-7-5-12-1-2-13(4-3-12)6-8-15(9-14)11-16/h1-4,9-11H,5-8H2
InChIKey YIGKAUDQJLANAV-UHFFFAOYSA-N
Mol Weight 287.2 g/mol
Molecular Formula C16H15Br
Exact Mass 286.035713 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID FckXcuASQtr
Name 5-Bromo-[2.2]metacyclophane
Alternate Name(s) 6-Bromotricyclo[9.2.2.1(4,8)]hexadeca-1(13),4(16),5,7,11,14-hexaene
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C16H15Br
InChI InChI=1S/C16H15Br/c17-16-10-14-7-5-12-1-2-13(4-3-12)6-8-15(9-14)11-16/h1-4,9-11H,5-8H2
InChIKey YIGKAUDQJLANAV-UHFFFAOYSA-N
Molecular Weight 287.200 g/mol
SMILES c12cc(CCc3ccc(CC2)cc3)cc(c1)Br
SPLASH splash10-0a4i-0390000000-9ca63e1369561790b08f
Source of Spectrum K-130-1108-5
Wiley ID 1289822