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Benzoazacrown-6a
SpectraBase Compound ID gUD6YDV87w
InChI InChI=1S/C13H17NO4/c15-10-11-1-2-12-13(9-11)18-8-7-17-6-5-16-4-3-14-12/h1-2,9-10,14H,3-8H2
InChIKey HSFYCBJMUMTSEX-UHFFFAOYSA-N
Mol Weight 251.28 g/mol
Molecular Formula C13H17NO4
Exact Mass 251.115758 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID DnW1PV6Dvvx
Name Benzoazacrown-6a
Alternate Name(s) 1-[4',7',10-Trioxa-1'-aza)-(3''-formyl)benzo[2,3-a]undecane 5,8,11-trioxa-2-azabicyclo[10.4.0]hexadeca-1(12),13,15-triene-14-carboxaldehyde
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C13H17NO4
InChI InChI=1S/C13H17NO4/c15-10-11-1-2-12-13(9-11)18-8-7-17-6-5-16-4-3-14-12/h1-2,9-10,14H,3-8H2
InChIKey HSFYCBJMUMTSEX-UHFFFAOYSA-N
Molecular Weight 251.282 g/mol
SMILES N1CCOCCOCCOc2c1ccc(c2)C=O
SPLASH splash10-0w2a-1920000000-38e8908c38928e8fa057
Source of Spectrum U1-2003-3197-6
Wiley ID 1523775