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

*Links on SpectraBase are not permalinks.
Isopropyl (1R,1aR,6bS)-1a,6b-dihydro-1H-cyclopropa[b]benzofuran-1-carboxylate
SpectraBase Compound ID LDAJPoRepWM
InChI InChI=1S/C13H14O3/c1-7(2)15-13(14)11-10-8-5-3-4-6-9(8)16-12(10)11/h3-7,10-12H,1-2H3/t10-,11-,12-/m1/s1
InChIKey CADISKWXGOKMCK-IJLUTSLNSA-N
Mol Weight 218.25 g/mol
Molecular Formula C13H14O3
Exact Mass 218.094294 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 6o9slFuaqmx
Name Isopropyl (1R,1aR,6bS)-1a,6b-dihydro-1H-cyclopropa[b]benzofuran-1-carboxylate
Appearance Yellow oil
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C13H14O3
InChI InChI=1S/C13H14O3/c1-7(2)15-13(14)11-10-8-5-3-4-6-9(8)16-12(10)11/h3-7,10-12H,1-2H3/t10-,11-,12-/m1/s1
InChIKey CADISKWXGOKMCK-IJLUTSLNSA-N
Instrument Name GCMS
Ionization Type EI
Literature Reference DOI 10.1002/anie.201903455
Molecular Weight 218.252 g/mol
SMILES c1cc2c(O[C@@]3([C@@]2([H])[C@]3(C(=O)OC(C)C)[H])[H])cc1
SPLASH splash10-001i-0900000000-8c010afa7201d3d2619e
Sample Comments >99.9% de, >99.9% ee
Source of Spectrum ACI-58-SM35-3c
Wiley ID 1875348