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Dimethyl 4,5-dicyano-2,7-dipentyloctanedioate

View entire compound with spectra: 1 MS (GC)

Dimethyl 4,5-dicyano-2,7-dipentyloctanedioate
SpectraBase Compound ID DdmWp0qVFre
InChI InChI=1S/C22H36N2O4/c1-5-7-9-11-17(21(25)27-3)13-19(15-23)20(16-24)14-18(22(26)28-4)12-10-8-6-2/h17-20H,5-14H2,1-4H3
InChIKey BVMPDDFSZZVSLB-UHFFFAOYSA-N
Mol Weight 392.5 g/mol
Molecular Formula C22H36N2O4
Exact Mass 392.267508 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID Erk5L7GDy9A
Name Dimethyl 4,5-dicyano-2,7-dipentyloctanedioate
CAS Registry Number 132341-15-2
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C22H36N2O4
InChI InChI=1S/C22H36N2O4/c1-5-7-9-11-17(21(25)27-3)13-19(15-23)20(16-24)14-18(22(26)28-4)12-10-8-6-2/h17-20H,5-14H2,1-4H3
InChIKey BVMPDDFSZZVSLB-UHFFFAOYSA-N
Molecular Weight 392.540 g/mol
SMILES C(#N)C(C(C#N)CC(C(=O)OC)CCCCC)CC(C(=O)OC)CCCCC
SPLASH splash10-0ap0-9410000000-bcfa8378ae4ee43a22cb
Source of Spectrum F-46-7016-2
Wiley ID 1365859