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Ethyl 5-(1-adamantyl)-1-phenyl-1,2,3-triazole-4-carboxylate
SpectraBase Compound ID LJtYabioPvS
InChI InChI=1S/C21H25N3O2/c1-2-26-20(25)18-19(24(23-22-18)17-6-4-3-5-7-17)21-11-14-8-15(12-21)10-16(9-14)13-21/h3-7,14-16H,2,8-13H2,1H3/t14-,15+,16-,21-
InChIKey OEYGLAXJKVTCRY-OFIQSVQDSA-N
Mol Weight 351.45 g/mol
Molecular Formula C21H25N3O2
Exact Mass 351.194677 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID YUgjjZvjGq
Name Ethyl 5-(1-adamantyl)-1-phenyl-1,2,3-triazole-4-carboxylate
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C21H25N3O2
InChI InChI=1S/C21H25N3O2/c1-2-26-20(25)18-19(24(23-22-18)17-6-4-3-5-7-17)21-11-14-8-15(12-21)10-16(9-14)13-21/h3-7,14-16H,2,8-13H2,1H3/t14-,15+,16-,21-
InChIKey OEYGLAXJKVTCRY-OFIQSVQDSA-N
Molecular Weight 351.450 g/mol
SMILES c1(nn[n](c1C12C[C@]3(C[C@](C[C@@](C2)(C3)[H])(C1)[H])[H])-c1ccccc1)C(=O)OCC
SPLASH splash10-000i-0922000000-cff130b05dff80dca708
Source of Spectrum SO-0-795-9
Synonyms Ethyl 5-(1-adamantyl)-1-phenyl-1H-1,2,3-triazole-4-carboxylate
Wiley ID 1544313