For citations & permissions, please see: Citations & Permissions - Wiley Science Solutions*

*Links on SpectraBase are not permalinks.
Diethyl (5-Methyl-5-nitro-1-phenylhexyl)malonate
SpectraBase Compound ID 7zgj24Pfzg2
InChI InChI=1S/C20H29NO6/c1-5-26-18(22)17(19(23)27-6-2)16(15-11-8-7-9-12-15)13-10-14-20(3,4)21(24)25/h7-9,11-12,16-17H,5-6,10,13-14H2,1-4H3
InChIKey SNWHEHHFAXOFJQ-UHFFFAOYSA-N
Mol Weight 379.45 g/mol
Molecular Formula C20H29NO6
Exact Mass 379.199488 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

View the Full Spectrum for FREE!

The full spectrum can only be viewed using a FREE account.

SpectraBase Spectrum ID 5jFGfAncEMC
Name Diethyl (5-Methyl-5-nitro-1-phenylhexyl)malonate
Alternate Name(s) Diethyl 2-(5-methyl-5-nitro-1-phenylhexyl)malonate
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C20H29NO6
InChI InChI=1S/C20H29NO6/c1-5-26-18(22)17(19(23)27-6-2)16(15-11-8-7-9-12-15)13-10-14-20(3,4)21(24)25/h7-9,11-12,16-17H,5-6,10,13-14H2,1-4H3
InChIKey SNWHEHHFAXOFJQ-UHFFFAOYSA-N
Molecular Weight 379.453 g/mol
SMILES C(N(=O)=O)(CCCC(C(C(=O)OCC)C(=O)OCC)c1ccccc1)(C)C
SPLASH splash10-014i-3900000000-62f981ca5b0491df6789
Source of Spectrum J-61-8238-38
Wiley ID 1359258