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2.alpha.-Bromo-4.beta.-phthalimidobicyclo[3.2.1]oct-6-en-3-one
SpectraBase Compound ID 5pT7UGbYnh2
InChI InChI=1S/C16H12BrNO3/c17-12-8-5-6-9(7-8)13(14(12)19)18-15(20)10-3-1-2-4-11(10)16(18)21/h1-6,8-9,12-13H,7H2/t8?,9?,12-,13-/m1/s1
InChIKey XVRZIUCJJCZWOQ-MFIKCIHMSA-N
Mol Weight 346.18 g/mol
Molecular Formula C16H12BrNO3
Exact Mass 345.000056 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID GC9iEoqtiG4
Name 2.alpha.-Bromo-4.beta.-phthalimidobicyclo[3.2.1]oct-6-en-3-one
Alternate Name(s) 2-[(2R,4R)-4-bromo-3-oxobicyclo[3.2.1]oct-6-en-2-yl]-1H-isoindole-1,3(2H)-dione
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Formula C16H12BrNO3
InChI InChI=1S/C16H12BrNO3/c17-12-8-5-6-9(7-8)13(14(12)19)18-15(20)10-3-1-2-4-11(10)16(18)21/h1-6,8-9,12-13H,7H2/t8?,9?,12-,13-/m1/s1
InChIKey XVRZIUCJJCZWOQ-MFIKCIHMSA-N
Molecular Weight 346.180 g/mol
SMILES C1(N(C(c2ccccc12)=O)[C@]1(C([C@](Br)(C2CC1C=C2)[H])=O)[H])=O
SPLASH splash10-0ufr-7590000000-f15068485fdc6d593427
Source of Spectrum J-61-1484-7
Wiley ID 1338531