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

*Links on SpectraBase are not permalinks.
2-Methyl-3-(1'-methylethenyl)-4,4-dicarbethoxycyclopentyl-3,5-Dinitrobenzoate
SpectraBase Compound ID IExZbugUeh
InChI InChI=1S/C22H26N2O10/c1-6-32-20(26)22(21(27)33-7-2)11-17(13(5)18(22)12(3)4)34-19(25)14-8-15(23(28)29)10-16(9-14)24(30)31/h8-10,13,17-18H,3,6-7,11H2,1-2,4-5H3
InChIKey LJILCCXACRZRQW-UHFFFAOYSA-N
Mol Weight 478.45 g/mol
Molecular Formula C22H26N2O10
Exact Mass 478.158745 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 HLEyWAK7emb
Name 2-Methyl-3-(1'-methylethenyl)-4,4-dicarbethoxycyclopentyl-3,5-Dinitrobenzoate
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C22H26N2O10
InChI InChI=1S/C22H26N2O10/c1-6-32-20(26)22(21(27)33-7-2)11-17(13(5)18(22)12(3)4)34-19(25)14-8-15(23(28)29)10-16(9-14)24(30)31/h8-10,13,17-18H,3,6-7,11H2,1-2,4-5H3
InChIKey LJILCCXACRZRQW-UHFFFAOYSA-N
Molecular Weight 478.454 g/mol
SMILES C1(C(C(C)C(C1)OC(c1cc([N+]([O-])=O)cc([N+]([O-])=O)c1)=O)C(=C)C)(C(=O)OCC)C(=O)OCC
SPLASH splash10-006y-0940000000-89a16b773b3f4030834a
Source of Spectrum F-47-8425-6
Wiley ID 1394657