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1H-2-Benzoxacyclododecin-1-one,3,4,5,6,7,8,9,10-octahydro-12-(benzyloxy)-14-methoxy-3-methyl

View entire compound with spectra: 1 NMR, and 4 MS (GC)

1H-2-Benzoxacyclododecin-1-one,3,4,5,6,7,8,9,10-octahydro-12-(benzyloxy)-14-methoxy-3-methyl
SpectraBase Compound ID 4moL18VnYSg
InChI InChI=1S/C24H30O4/c1-18-11-7-4-3-5-10-14-20-15-21(27-17-19-12-8-6-9-13-19)16-22(26-2)23(20)24(25)28-18/h6,8-9,12-13,15-16,18H,3-5,7,10-11,14,17H2,1-2H3
InChIKey QZEHRWBUKWLCAI-UHFFFAOYSA-N
Mol Weight 382.5 g/mol
Molecular Formula C24H30O4
Exact Mass 382.214409 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID AYzmPWDc0na
Name 1H-2-Benzoxacyclododecin-1-one,3,4,5,6,7,8,9,10-octahydro-12-(benzyloxy)-14-methoxy-3-methyl
Comments Computed using HOSE algorithm
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 382.214409442 u
Formula C24H30O4
InChI InChI=1S/C24H30O4/c1-18-11-7-4-3-5-10-14-20-15-21(27-17-19-12-8-6-9-13-19)16-22(26-2)23(20)24(25)28-18/h6,8-9,12-13,15-16,18H,3-5,7,10-11,14,17H2,1-2H3
InChIKey QZEHRWBUKWLCAI-UHFFFAOYSA-N
Molecular Weight 382.500 g/mol
SMILES C1=CC(COC2=CC=3CCCCCCCC(C)OC(C3C(=C2)OC)=O)=CC=C1