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anti-4'-Cyano-5-bromo-spiro[adamantane-2,2'-octane]
SpectraBase Compound ID 45L3ffI09jz
InChI InChI=1S/C13H16BrNO/c14-12-3-8-1-9(4-12)13(10(2-8)5-12)6-11(7-15)16-13/h8-11H,1-6H2/t8-,9-,10+,11?,12-,13-
InChIKey CNVGEOBNASVVLH-RFUKVRNNSA-N
Mol Weight 282.18 g/mol
Molecular Formula C13H16BrNO
Exact Mass 281.041527 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 6pCxlIit3Hv
Name anti-4'-Cyano-5-bromo-spiro[adamantane-2,2'-octane]
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C13H16BrNO
InChI InChI=1S/C13H16BrNO/c14-12-3-8-1-9(4-12)13(10(2-8)5-12)6-11(7-15)16-13/h8-11H,1-6H2/t8-,9-,10+,11?,12-,13-
InChIKey CNVGEOBNASVVLH-RFUKVRNNSA-N
Molecular Weight 282.181 g/mol
SMILES [C@]12([C@@]3(C[C@]4(C[C@]2(C[C@](C4)(C3)[H])[H])Br)[H])OC(C#N)C1
SPLASH splash10-0udm-8690000000-b72142f81cb3ea275b1f
Source of Spectrum KC-0-556-5
Synonyms 1-Bromo-2'-spiro[adamantane-4,4'-oxetane]carbonitrile 1-Bromanylspiro[adamantane-4,4'-oxetane]-2'-carbonitrile
Wiley ID 822204