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Methyl 2-(1-formyl-6-nitronaphthalen-2-yloxy)pentanoate
SpectraBase Compound ID 1sfdnSkQ2jj
InChI InChI=1S/C17H17NO6/c1-3-4-16(17(20)23-2)24-15-8-5-11-9-12(18(21)22)6-7-13(11)14(15)10-19/h5-10,16H,3-4H2,1-2H3
InChIKey XBBAGIQHVWCSIF-UHFFFAOYSA-N
Mol Weight 331.32 g/mol
Molecular Formula C17H17NO6
Exact Mass 331.105587 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 6AQGCkpYFTo
Name Methyl 2-(1-formyl-6-nitronaphthalen-2-yloxy)pentanoate
Alternate Name(s) Methyl 2-((1-formyl-6-nitronaphthalen-2-yl)oxy)pentanoate
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C17H17NO6
InChI InChI=1S/C17H17NO6/c1-3-4-16(17(20)23-2)24-15-8-5-11-9-12(18(21)22)6-7-13(11)14(15)10-19/h5-10,16H,3-4H2,1-2H3
InChIKey XBBAGIQHVWCSIF-UHFFFAOYSA-N
Literature Reference DOI 10.1080/00304948.2015.1005982
Molecular Weight 331.324 g/mol
SMILES c1cc2c(cc1[N+](=O)[O-])ccc(c2C=O)OC(C(OC)=O)CCC
SPLASH splash10-014i-0191000000-b5969e6fe7442adcc363
Source of Spectrum A3-47-137-3c
Wiley ID 1802199