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N-(4-Methoxybenzyl)-(1R*,2S*)-2-(phenylethynyl)cyclopropanecarboxamide
SpectraBase Compound ID 4MyDYyy7vMl
InChI InChI=1S/C20H19NO2/c1-23-18-11-8-16(9-12-18)14-21-20(22)19-13-17(19)10-7-15-5-3-2-4-6-15/h2-6,8-9,11-12,17,19H,13-14H2,1H3,(H,21,22)/t17-,19+/m0/s1
InChIKey ZBASDQGPGGZEIQ-PKOBYXMFSA-N
Mol Weight 305.38 g/mol
Molecular Formula C20H19NO2
Exact Mass 305.141579 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID HSAfFnUd4a6
Name N-(4-Methoxybenzyl)-(1R*,2S*)-2-(phenylethynyl)cyclopropanecarboxamide
Alternate Name(s) (1R,2S)-N-(4-methoxybenzyl)-2-(phenylethynyl)cyclopropanecarboxamide
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C20H19NO2
InChI InChI=1S/C20H19NO2/c1-23-18-11-8-16(9-12-18)14-21-20(22)19-13-17(19)10-7-15-5-3-2-4-6-15/h2-6,8-9,11-12,17,19H,13-14H2,1H3,(H,21,22)/t17-,19+/m0/s1
InChIKey ZBASDQGPGGZEIQ-PKOBYXMFSA-N
Literature Reference DOI 10.1021/ol1029996
Molecular Weight 305.377 g/mol
SMILES N(C([C@@]1(C[C@]1([H])C#Cc1ccccc1)[H])=O)Cc1ccc(cc1)OC
SPLASH splash10-00e9-2930000000-a37b286794099622c585
Source of Spectrum A1-13-956/SMS18-32
Wiley ID 1752783