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Macrocyclic N-tert-Butoxycarbonyl Amino Enone
SpectraBase Compound ID EGEjfgKxn2z
InChI InChI=1S/C22H27NO5/c1-22(2,3)28-21(25)23-9-4-5-14-6-7-17(24)20(14)16-12-19-18(26-13-27-19)11-15(16)8-10-23/h11-12H,4-10,13H2,1-3H3
InChIKey YECGRXYZVJDANS-UHFFFAOYSA-N
Mol Weight 385.46 g/mol
Molecular Formula C22H27NO5
Exact Mass 385.188923 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 8QIALwW3gQG
Name Macrocyclic N-tert-Butoxycarbonyl Amino Enone
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C22H27NO5
InChI InChI=1S/C22H27NO5/c1-22(2,3)28-21(25)23-9-4-5-14-6-7-17(24)20(14)16-12-19-18(26-13-27-19)11-15(16)8-10-23/h11-12H,4-10,13H2,1-3H3
InChIKey YECGRXYZVJDANS-UHFFFAOYSA-N
Molecular Weight 385.460 g/mol
SMILES c12C3=C(CCC3=O)CCCN(C(OC(C)(C)C)=O)CCc1cc1c(c2)OCO1
SPLASH splash10-0a4i-9033000000-373112c73d183cfd099b
Source of Spectrum J-61-7346-37
Synonyms tert-Butyl 1-oxo-1,2,3,4,5,6,8,9-octahydro-7H-cyclopenta[g][1,3]dioxolo[4,5-k][3]benzazecine-7-carboxylate
Wiley ID 1362268