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N-[(R)-1-Phenylethyl]-(2S,5S)-2,5-dimethylcyclopentanecarboxylic amide

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N-[(R)-1-Phenylethyl]-(2S,5S)-2,5-dimethylcyclopentanecarboxylic amide
SpectraBase Compound ID 3yDYECXD6AL
InChI InChI=1S/C16H23NO/c1-11-9-10-12(2)15(11)16(18)17-13(3)14-7-5-4-6-8-14/h4-8,11-13,15H,9-10H2,1-3H3,(H,17,18)/t11-,12-,13+/m0/s1
InChIKey URZFQEZORGBOFJ-RWMBFGLXSA-N
Mol Weight 245.37 g/mol
Molecular Formula C16H23NO
Exact Mass 245.177964 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 8LwZnsUlSW2
Name N-[(R)-1-Phenylethyl]-(2S,5S)-2,5-dimethylcyclopentanecarboxylic amide
Comments Computed using HOSE algorithm
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Exact Mass 245.177964364 u
Formula C16H23NO
InChI InChI=1S/C16H23NO/c1-11-9-10-12(2)15(11)16(18)17-13(3)14-7-5-4-6-8-14/h4-8,11-13,15H,9-10H2,1-3H3,(H,17,18)/t11-,12-,13+/m0/s1
InChIKey URZFQEZORGBOFJ-RWMBFGLXSA-N
Molecular Weight 245.366 g/mol
SMILES C(N[C@@](C1=CC=CC=C1)(C)[H])(C1[C@](CC[C@@]1(C)[H])(C)[H])=O