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2-(1-Adamantyl)-1-(4-nitrophenyl)ethanone
SpectraBase Compound ID G5lEOzGY4eD
InChI InChI=1S/C18H21NO3/c20-17(15-1-3-16(4-2-15)19(21)22)11-18-8-12-5-13(9-18)7-14(6-12)10-18/h1-4,12-14H,5-11H2/t12-,13+,14-,18-
InChIKey VXIPMGLRVVYRLZ-WXZYKRPKSA-N
Mol Weight 299.37 g/mol
Molecular Formula C18H21NO3
Exact Mass 299.152144 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID AukvFktyzXx
Name 2-(1-Adamantyl)-1-(4-nitrophenyl)ethanone
Appearance Colorless solid
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C18H21NO3
InChI InChI=1S/C18H21NO3/c20-17(15-1-3-16(4-2-15)19(21)22)11-18-8-12-5-13(9-18)7-14(6-12)10-18/h1-4,12-14H,5-11H2/t12-,13+,14-,18-
InChIKey VXIPMGLRVVYRLZ-WXZYKRPKSA-N
Instrument Name Shimadzu QP???2010
Ionization Type EI
Literature Reference DOI 10.3998/ark.5550190.0010.c06
Molecular Weight 299.370 g/mol
SMILES C(CC12C[C@]3(C[C@](C[C@@](C2)(C3)[H])(C1)[H])[H])(=O)c1ccc(cc1)[N+](=O)[O-]
SPLASH splash10-002o-9510000000-d5fb7072d85aab78c6a1
Source of Spectrum ARK-2009-76-6c
Thin-Layer Chromatography Rf = 0.33 (petroleum ether/ethyl acetate, 8:1)
Wiley ID 1869770