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5-ETHOXY-3-ETHYL-7-METHYL-4,5,6,7-TETRAHYDROOXEPINE-4,4-DICARBONITRILE

View entire compound with spectra: 1 NMR, and 1 MS (GC)

5-ETHOXY-3-ETHYL-7-METHYL-4,5,6,7-TETRAHYDROOXEPINE-4,4-DICARBONITRILE
SpectraBase Compound ID AC7hnGnMH8K
InChI InChI=1S/C13H18N2O2/c1-4-11-7-17-10(3)6-12(16-5-2)13(11,8-14)9-15/h7,10,12H,4-6H2,1-3H3
InChIKey MFRSXYSNPGWKNR-UHFFFAOYSA-N
Mol Weight 234.3 g/mol
Molecular Formula C13H18N2O2
Exact Mass 234.136828 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 2pLvRwpdZsL
Name 4-Ethoxy-6-ethyl-2-methyl-3,4-dihydro-2H-oxepin-5,5-dicarbonitrile
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C13H18N2O2
InChI InChI=1S/C13H18N2O2/c1-4-11-7-17-10(3)6-12(16-5-2)13(11,8-14)9-15/h7,10,12H,4-6H2,1-3H3
InChIKey MFRSXYSNPGWKNR-UHFFFAOYSA-N
Molecular Weight 234.299 g/mol
SMILES C1(C(=COC(CC1OCC)C)CC)(C#N)C#N
SPLASH splash10-000j-9700000000-32fa3629e190ae492ef3
Source of Spectrum KC-0-317-20
Synonyms 4-Ethoxy-6-ethyl-2-methyl-3,4-dihydro-2H-oxepine-5,5-dicarbonitrile
Wiley ID 824228