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3-[(3-Methoxy-propylamino)-methyl]-5,8a-dimethyl-3a,4,6,7,8,8a,9,9a-octahydro-3H-naphtho[2,3-b]furan-2-one
SpectraBase Compound ID 5TMBjreTXWM
InChI InChI=1S/C19H31NO3/c1-13-6-4-7-19(2)11-17-14(10-16(13)19)15(18(21)23-17)12-20-8-5-9-22-3/h14-15,17,20H,4-12H2,1-3H3
InChIKey BGKMCMULUPGYJR-UHFFFAOYSA-N
Mol Weight 321.46 g/mol
Molecular Formula C19H31NO3
Exact Mass 321.230394 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 2fuspfSFyiA
Name 3-[(3-Methoxy-propylamino)-methyl]-5,8A-dimethyl-3A,4,6,7,8,8A,9,9A-octahydro-3H-naphtho[2,3-B]furan-2-one
Comments Computed using HOSE algorithm
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 321.230393859 u
Formula C19H31NO3
InChI InChI=1S/C19H31NO3/c1-13-6-4-7-19(2)11-17-14(10-16(13)19)15(18(21)23-17)12-20-8-5-9-22-3/h14-15,17,20H,4-12H2,1-3H3
InChIKey BGKMCMULUPGYJR-UHFFFAOYSA-N
Molecular Weight 321.461 g/mol
SMILES C1(C(C2CC3=C(CCCC3(CC2O1)C)C)CNCCCOC)=O