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Propyl (cis)-N-{2-{4'-[(2""-hydroxycyclohexyl)methyl]phenoxy}ethyl}carbamate
SpectraBase Compound ID KtrlHLClI5X
InChI InChI=1S/C19H29NO4/c1-2-12-24-19(22)20-11-13-23-17-9-7-15(8-10-17)14-16-5-3-4-6-18(16)21/h7-10,16,18,21H,2-6,11-14H2,1H3,(H,20,22)/t16-,18-/m1/s1
InChIKey AYVVUVAHRPZBNI-SJLPKXTDSA-N
Mol Weight 335.44 g/mol
Molecular Formula C19H29NO4
Exact Mass 335.209658 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 1uj19VaYjW3
Name Propyl (cis)-N-{2-{4'-[(2""-hydroxycyclohexyl)methyl]phenoxy}ethyl}carbamate
Comments Computed using HOSE algorithm
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Exact Mass 335.209658414 u
Formula C19H29NO4
InChI InChI=1S/C19H29NO4/c1-2-12-24-19(22)20-11-13-23-17-9-7-15(8-10-17)14-16-5-3-4-6-18(16)21/h7-10,16,18,21H,2-6,11-14H2,1H3,(H,20,22)/t16-,18-/m1/s1
InChIKey AYVVUVAHRPZBNI-SJLPKXTDSA-N
Molecular Weight 335.444 g/mol
SMILES C(=O)(NCCOC1=CC=C(C[C@@]2([C@](O)(CCCC2)[H])[H])C=C1)OCCC