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2-(p-Cyanobenzoyl)-2-methyladamantane
SpectraBase Compound ID ClaqQDpargH
InChI InChI=1S/C19H21NO/c1-19(18(21)15-4-2-12(11-20)3-5-15)16-7-13-6-14(9-16)10-17(19)8-13/h2-5,13-14,16-17H,6-10H2,1H3/t13-,14+,16-,17+,19?
InChIKey GSFWQICCQVQQJA-TXFLSZFTSA-N
Mol Weight 279.38 g/mol
Molecular Formula C19H21NO
Exact Mass 279.162314 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 3ApaYXFhCYS
Name 2-(p-Cyanobenzoyl)-2-methyladamantane
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C19H21NO
InChI InChI=1S/C19H21NO/c1-19(18(21)15-4-2-12(11-20)3-5-15)16-7-13-6-14(9-16)10-17(19)8-13/h2-5,13-14,16-17H,6-10H2,1H3/t13-,14+,16-,17+,19?
InChIKey GSFWQICCQVQQJA-TXFLSZFTSA-N
Molecular Weight 279.383 g/mol
SMILES C1([C@]2(C[C@]3(C[C@@]1(C[C@](C3)(C2)[H])[H])[H])[H])(C(c1ccc(C#N)cc1)=O)C
SPLASH splash10-001m-7920000000-6dd7349f3e68524fcde3
Source of Spectrum C-120-12766-5e
Wiley ID 1699999