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(cis)-2-[4'-(2""""-Hydroxycyclohex-1""""-ylmethyl)phenoxy]ethyl} N-ethylcarbamate
SpectraBase Compound ID 6SsWK2SBeFR
InChI InChI=1S/C18H27NO4/c1-2-19-18(21)23-12-11-22-16-9-7-14(8-10-16)13-15-5-3-4-6-17(15)20/h7-10,15,17,20H,2-6,11-13H2,1H3,(H,19,21)/t15-,17-/m1/s1
InChIKey BWBGESVYMSSRPR-NVXWUHKLSA-N
Mol Weight 321.42 g/mol
Molecular Formula C18H27NO4
Exact Mass 321.194008 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID Ev8okd8sf9M
Name (cis)-2-[4'-(2""""-Hydroxycyclohex-1""""-ylmethyl)phenoxy]ethyl} N-ethylcarbamate
Comments Computed using HOSE algorithm
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 321.194008349 u
Formula C18H27NO4
InChI InChI=1S/C18H27NO4/c1-2-19-18(21)23-12-11-22-16-9-7-14(8-10-16)13-15-5-3-4-6-17(15)20/h7-10,15,17,20H,2-6,11-13H2,1H3,(H,19,21)/t15-,17-/m1/s1
InChIKey BWBGESVYMSSRPR-NVXWUHKLSA-N
Molecular Weight 321.417 g/mol
SMILES C(=O)(NCC)OCCOC=1C=CC(C[C@@]2([C@](O)(CCCC2)[H])[H])=CC1