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3-Me-4-MA 2PE
SpectraBase Compound ID 4fwTdsvde6d
InChI InChI=1S/C21H37NO/c1-6-8-10-14-22(15-11-9-7-2)19(4)17-20-12-13-21(23-5)18(3)16-20/h12-13,16,19H,6-11,14-15,17H2,1-5H3
InChIKey ZBPLGKJACDZHFY-UHFFFAOYSA-N
Mol Weight 319.5 g/mol
Molecular Formula C21H37NO
Exact Mass 319.287515 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 2GgkqAYwLnO
Name 3-me-4-ma 2pe
Comments Computed using HOSE algorithm
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 319.287514814 u
Formula C21H37NO
InChI InChI=1S/C21H37NO/c1-6-8-10-14-22(15-11-9-7-2)19(4)17-20-12-13-21(23-5)18(3)16-20/h12-13,16,19H,6-11,14-15,17H2,1-5H3
InChIKey ZBPLGKJACDZHFY-UHFFFAOYSA-N
Molecular Weight 319.533 g/mol
SMILES C1(CC(N(CCCCC)CCCCC)C)=CC(=C(C=C1)OC)C