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(5rs)-5-[(1R)-Menthyloxy]-3-phenyl-4,5-dihydroisoxazole
SpectraBase Compound ID 8jSHS11NgKf
InChI InChI=1S/C19H27NO2/c1-13(2)16-10-9-14(3)11-18(16)21-19-12-17(20-22-19)15-7-5-4-6-8-15/h4-8,13-14,16,18-19H,9-12H2,1-3H3/t14-,16?,18?,19?/m1/s1
InChIKey GYAPFBQSQDAQLF-NCDKBSFVSA-N
Mol Weight 301.43 g/mol
Molecular Formula C19H27NO2
Exact Mass 301.204179 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID AeUIuIxac1U
Name (5rs)-5-[(1R)-Menthyloxy]-3-phenyl-4,5-dihydroisoxazole
Comments Computed using HOSE algorithm
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 301.204179111 u
Formula C19H27NO2
InChI InChI=1S/C19H27NO2/c1-13(2)16-10-9-14(3)11-18(16)21-19-12-17(20-22-19)15-7-5-4-6-8-15/h4-8,13-14,16,18-19H,9-12H2,1-3H3/t14-,16?,18?,19?/m1/s1
InChIKey GYAPFBQSQDAQLF-NCDKBSFVSA-N
SMILES C1(=NOC(C1)OC1C(CC[C@](C1)(C)[H])C(C)C)C=1C=CC=CC1