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tert-Butyl (1S,2S)-2-(1-phenylethyl)cyclohex-3-enecarboxylate
SpectraBase Compound ID 5EMNrhkXQ4N
InChI InChI=1S/C19H26O2/c1-14(15-10-6-5-7-11-15)16-12-8-9-13-17(16)18(20)21-19(2,3)4/h5-8,10-12,14,16-17H,9,13H2,1-4H3/t14?,16-,17-/m0/s1
InChIKey KRBDGFJWVXTMME-HGVHAKBWSA-N
Mol Weight 286.41 g/mol
Molecular Formula C19H26O2
Exact Mass 286.19328 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID DLQe1dZEyNI
Name tert-Butyl (1S,2S)-2-(1-phenylethyl)cyclohex-3-enecarboxylate
Appearance Colorless liquid
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C19H26O2
InChI InChI=1S/C19H26O2/c1-14(15-10-6-5-7-11-15)16-12-8-9-13-17(16)18(20)21-19(2,3)4/h5-8,10-12,14,16-17H,9,13H2,1-4H3/t14?,16-,17-/m0/s1
InChIKey KRBDGFJWVXTMME-HGVHAKBWSA-N
Instrument Name Agilent 6890N-5975
Ionization Type EI
Literature Reference DOI 10.3762/bjoc.8.72
Molecular Weight 286.415 g/mol
Reported Formula C19H26O2
SMILES C1C[C@@]([C@@](C=C1)(C(c1ccccc1)C)[H])(C(=O)OC(C)(C)C)[H]
SPLASH splash10-0a4i-2910000000-1111cb7ae168f982cfa5
Source of Spectrum BJO-8-SM15-6i
Wiley ID 1867430