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

*Links on SpectraBase are not permalinks.
Ethyl (4aS*,7R*,8R*,8aS*)-7-phenyl-1-oxo-3,4,4a,7,8,8a-hexahydro-1H-isochromene-8-carboxylate
SpectraBase Compound ID 1QWvNuD1Ghz
InChI InChI=1S/C18H20O4/c1-2-21-18(20)16-14(12-6-4-3-5-7-12)9-8-13-10-11-22-17(19)15(13)16/h3-9,13-16H,2,10-11H2,1H3/t13-,14+,15+,16-/m1/s1
InChIKey SQBZRWBQNKGARY-FXUDXRNXSA-N
Mol Weight 300.35 g/mol
Molecular Formula C18H20O4
Exact Mass 300.136159 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 4p1KPEZLdaS
Name Ethyl (4aS*,7R*,8R*,8aS*)-7-phenyl-1-oxo-3,4,4a,7,8,8a-hexahydro-1H-isochromene-8-carboxylate
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C18H20O4
InChI InChI=1S/C18H20O4/c1-2-21-18(20)16-14(12-6-4-3-5-7-12)9-8-13-10-11-22-17(19)15(13)16/h3-9,13-16H,2,10-11H2,1H3/t13-,14+,15+,16-/m1/s1
InChIKey SQBZRWBQNKGARY-FXUDXRNXSA-N
Molecular Weight 300.354 g/mol
SMILES [C@@]1([C@@](C=C[C@]2([C@@]1(C(OCC2)=O)[H])[H])(c1ccccc1)[H])(C(=O)OCC)[H]
SPLASH splash10-0a6u-6981000000-d022c923f9198a46f8f6
Source of Spectrum F-67-189-24d
Wiley ID 1685352