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Benzaldehyde, 3-(1-adamantyl)-4-diethylamino-
SpectraBase Compound ID EOKJKDpHuDj
InChI InChI=1S/C21H29NO/c1-3-22(4-2)20-6-5-15(14-23)10-19(20)21-11-16-7-17(12-21)9-18(8-16)13-21/h5-6,10,14,16-18H,3-4,7-9,11-13H2,1-2H3/t16-,17+,18-,21-
InChIKey HHXPKZZZNGJHTD-KCPQFBADSA-N
Mol Weight 311.47 g/mol
Molecular Formula C21H29NO
Exact Mass 311.224915 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID FmxGiFLWfgm
Name Benzaldehyde, 3-(1-adamantyl)-4-diethylamino-
Alternate Name(s) 3-(1-Adamantyl)-4-(diethylamino)benzaldehyde
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Formula C21H29NO
InChI InChI=1S/C21H29NO/c1-3-22(4-2)20-6-5-15(14-23)10-19(20)21-11-16-7-17(12-21)9-18(8-16)13-21/h5-6,10,14,16-18H,3-4,7-9,11-13H2,1-2H3/t16-,17+,18-,21-
InChIKey HHXPKZZZNGJHTD-KCPQFBADSA-N
Molecular Weight 311.469 g/mol
SMILES C12(c3c(ccc(c3)C=O)N(CC)CC)C[C@]3(C[C@@](C1)(C[C@@](C2)(C3)[H])[H])[H]
SPLASH splash10-004i-2900000000-6c88f96e2be14f30bde6
Source of Spectrum AD-0-2532-0
Wiley ID 1433270