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TRANS-(2RS,4SR)-4-(N-ACETYL-N-BENZYLAMINO)-3,4-DIHYDRO-2-ISOBUTOXY-2H-PYRAN-5-CARBONITRILE
SpectraBase Compound ID 1fSlKdYgbpX
InChI InChI=1S/C19H24N2O3/c1-14(2)12-23-19-9-18(17(10-20)13-24-19)21(15(3)22)11-16-7-5-4-6-8-16/h4-8,13-14,18-19H,9,11-12H2,1-3H3/t18-,19+/m0/s1
InChIKey HRXSDBLIAVEIJG-RBUKOAKNSA-N
Mol Weight 328.41 g/mol
Molecular Formula C19H24N2O3
Exact Mass 328.178693 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID FPWgqOqvGcd
Name (2RS,4SR)-4-(N-Acetyl-N-benzylamino)-2-isobutoxy-3,4-dihydro-2H-pyran-5-carbonitrile
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C19H24N2O3
InChI InChI=1S/C19H24N2O3/c1-14(2)12-23-19-9-18(17(10-20)13-24-19)21(15(3)22)11-16-7-5-4-6-8-16/h4-8,13-14,18-19H,9,11-12H2,1-3H3/t18-,19+/m0/s1
InChIKey HRXSDBLIAVEIJG-RBUKOAKNSA-N
Molecular Weight 328.412 g/mol
SMILES C=1([C@@](N(C(=O)C)Cc2ccccc2)(C[C@@](OC1)(OCC(C)C)[H])[H])C#N
SPLASH splash10-0005-4920000000-6f87d69cc2a0ba4906a3
Source of Spectrum AH-139-652-trans-5b
Wiley ID 1695647