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(3S,4'S)-3-(Benzylmethylamino)-4-(2',2'-dimethyl-1',3'-dioxolan-4'-yl)-1-cyano-2-methoxyprop-1-ene
SpectraBase Compound ID 4LWGII57Dt3
InChI InChI=1S/C18H24N2O3/c1-18(2)22-13-16(23-18)17(15(21-4)10-11-19)20(3)12-14-8-6-5-7-9-14/h5-10,16-17H,12-13H2,1-4H3/b15-10+/t16-,17-/m1/s1
InChIKey YIVXBZLAIHIBQW-QYHCQRMFSA-N
Mol Weight 316.4 g/mol
Molecular Formula C18H24N2O3
Exact Mass 316.178693 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID HYRCAY9yUDS
Name (3S,4'S)-3-(Benzylmethylamino)-4-(2',2'-dimethyl-1',3'-dioxolan-4'-yl)-1-cyano-2-methoxyprop-1-ene
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C18H24N2O3
InChI InChI=1S/C18H24N2O3/c1-18(2)22-13-16(23-18)17(15(21-4)10-11-19)20(3)12-14-8-6-5-7-9-14/h5-10,16-17H,12-13H2,1-4H3/b15-10+/t16-,17-/m1/s1
InChIKey YIVXBZLAIHIBQW-QYHCQRMFSA-N
Molecular Weight 316.401 g/mol
SMILES [C@]1([C@](N(Cc2ccccc2)C)(\C(=C/C#N)OC)[H])(OC(C)(C)OC1)[H]
SPLASH splash10-00kf-9061000000-b9cdba54798251c2f198
Source of Spectrum F4-43-117-31
Synonyms (E)-(S)-4-(Benzyl-methyl-amino)-4-((S)-2,2-dimethyl-[1,3]dioxolan-4-yl)-3-methoxy-but-2-enenitrile
Wiley ID 1675010