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Methyl 2-cyanonaphtho[1,2-1',2']adamantan-2-carboxylate
SpectraBase Compound ID DsRta1aBudQ
InChI InChI=1S/C22H23NO2/c1-25-20(24)22(13-23)12-21-10-15-6-14(7-16(8-15)11-21)9-19(21)17-4-2-3-5-18(17)22/h2-5,9,14-16H,6-8,10-12H2,1H3/t14-,15+,16-,21+,22?
InChIKey CUXYBDWBPWIPKH-UHFFFAOYSA-N
Mol Weight 333.43 g/mol
Molecular Formula C22H23NO2
Exact Mass 333.172879 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID CJQLbV0yoUr
Name Methyl 2-cyanonaphtho[1,2-1',2']adamantan-2-carboxylate
Copyright Copyright © 2020-2025 John Wiley & Sons, Inc. All Rights Reserved.
Formula C22H23NO2
InChI InChI=1S/C22H23NO2/c1-25-20(24)22(13-23)12-21-10-15-6-14(7-16(8-15)11-21)9-19(21)17-4-2-3-5-18(17)22/h2-5,9,14-16H,6-8,10-12H2,1H3/t14-,15+,16-,21+,22?
InChIKey CUXYBDWBPWIPKH-UHFFFAOYSA-N
Molecular Weight 333.431 g/mol
SMILES C1(c2c(C3=C[C@]4(C[C@@]5(C[C@]3(C1)C[C@](C4)(C5)[H])[H])[H])cccc2)(C(=O)OC)C#N
SPLASH splash10-0089-0097000000-98948c2b69a718042a9c
Source of Spectrum C-118-7081-18
Wiley ID 759676