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

*Links on SpectraBase are not permalinks.
3-Benzyl 3-ethyl 6-oxo-4-pentyl-2H-pyran-3,3(6H)-dicarboxylate
SpectraBase Compound ID IDcNv86aNIu
InChI InChI=1S/C21H26O6/c1-3-5-7-12-17-13-18(22)27-15-21(17,19(23)25-4-2)20(24)26-14-16-10-8-6-9-11-16/h6,8-11,13H,3-5,7,12,14-15H2,1-2H3
InChIKey AQEXZGWNTKRGQL-UHFFFAOYSA-N
Mol Weight 374.43 g/mol
Molecular Formula C21H26O6
Exact Mass 374.172939 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 F7aybbHxkAq
Name 3-Benzyl 3-ethyl 6-oxo-4-pentyl-2H-pyran-3,3(6H)-dicarboxylate
Comments Less than 3 mono-isotopic peaks
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C21H26O6
InChI InChI=1S/C21H26O6/c1-3-5-7-12-17-13-18(22)27-15-21(17,19(23)25-4-2)20(24)26-14-16-10-8-6-9-11-16/h6,8-11,13H,3-5,7,12,14-15H2,1-2H3
InChIKey AQEXZGWNTKRGQL-UHFFFAOYSA-N
Molecular Weight 374.433 g/mol
SMILES C1(C(=CC(OC1)=O)CCCCC)(C(OCc1ccccc1)=O)C(=O)OCC
SPLASH splash10-0006-9000000000-84ba2a45b39c8d86c19a
Source of Spectrum F-65-2114-4cf
Wiley ID 1681607