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TRANS-(2RS,4SR)-4-(N-ACETYL-N-BENZYLAMINO)-3,4-DIHYDRO-2-METHOXY-2-METHYL-2H-PYRAN-5-CARBONITRILE
SpectraBase Compound ID EMPWFH6bb7a
InChI InChI=1S/C17H20N2O3/c1-13(20)19(11-14-7-5-4-6-8-14)16-9-17(2,21-3)22-12-15(16)10-18/h4-8,12,16H,9,11H2,1-3H3/t16-,17+/m0/s1
InChIKey NZRXRBBHOPAKDA-DLBZAZTESA-N
Mol Weight 300.36 g/mol
Molecular Formula C17H20N2O3
Exact Mass 300.147393 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 7uhzsxfyqjS
Name (2RS,4SR)-4-(N-Acetyl-N-benzylamino)-2-methoxy-2-methyl-3,4-dihydro-2H-pyran-5-carbonitrile
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C17H20N2O3
InChI InChI=1S/C17H20N2O3/c1-13(20)19(11-14-7-5-4-6-8-14)16-9-17(2,21-3)22-12-15(16)10-18/h4-8,12,16H,9,11H2,1-3H3/t16-,17+/m0/s1
InChIKey NZRXRBBHOPAKDA-DLBZAZTESA-N
Molecular Weight 300.358 g/mol
SMILES C=1([C@@](N(C(=O)C)Cc2ccccc2)(C[C@@](OC1)(OC)C)[H])C#N
SPLASH splash10-006x-8900000000-6513cbe9512e08854e32
Source of Spectrum AH-139-653-trans-5d
Wiley ID 1695643