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(E)-methyl 1-acetyl-2-(3-(tert-butoxycarbonylamino)benzylidene)cyclopentanecarboxylate
SpectraBase Compound ID Kq9l1l0Z7Bo
InChI InChI=1S/C21H27NO5/c1-14(23)21(18(24)26-5)11-7-9-16(21)12-15-8-6-10-17(13-15)22-19(25)27-20(2,3)4/h6,8,10,12-13H,7,9,11H2,1-5H3,(H,22,25)/b16-12+
InChIKey QRAADYMTMSWSHN-FOWTUZBSSA-N
Mol Weight 373.45 g/mol
Molecular Formula C21H27NO5
Exact Mass 373.188923 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID Lff55ilrDlD
Name (E)-methyl 1-acetyl-2-(3-(tert-butoxycarbonylamino)benzylidene)cyclopentanecarboxylate
Alternate Name(s) Methyl (E)-1-acetyl-2-(3-((tert-butoxycarbonyl)amino)benzylidene)cyclopentane-1-carboxylate
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C21H27NO5
InChI InChI=1S/C21H27NO5/c1-14(23)21(18(24)26-5)11-7-9-16(21)12-15-8-6-10-17(13-15)22-19(25)27-20(2,3)4/h6,8,10,12-13H,7,9,11H2,1-5H3,(H,22,25)/b16-12+
InChIKey QRAADYMTMSWSHN-FOWTUZBSSA-N
Literature Reference DOI 10.1002/adsc.201600175
Molecular Weight 373.449 g/mol
SMILES N(C(OC(C)(C)C)=O)c1cccc(c1)\C=C/1CCCC1(C(OC)=O)C(C)=O
SPLASH splash10-0597-6930000000-c0d3b504a8facaee1911
Source of Spectrum ASC-358-1820/SM8-19
Wiley ID 1807393