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(+)-i-Propyl (3aR,7aS)-2,2-dimethyl-3a,7a-dihydrobenzo[d]-[1,3]dioxole-4-carboxylate

View entire compound with spectra: 1 MS (GC)

(+)-i-Propyl (3aR,7aS)-2,2-dimethyl-3a,7a-dihydrobenzo[d]-[1,3]dioxole-4-carboxylate
SpectraBase Compound ID AmwE5VOQNNt
InChI InChI=1S/C13H18O4/c1-8(2)15-12(14)9-6-5-7-10-11(9)17-13(3,4)16-10/h5-8,10-11H,1-4H3/t10-,11+/m0/s1
InChIKey ZBKGQZBZSCNWJD-WDEREUQCSA-N
Mol Weight 238.28 g/mol
Molecular Formula C13H18O4
Exact Mass 238.120509 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID Hfpcm2rAiuv
Name (+)-i-Propyl (3aR,7aS)-2,2-dimethyl-3a,7a-dihydrobenzo[d]-[1,3]dioxole-4-carboxylate
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C13H18O4
InChI InChI=1S/C13H18O4/c1-8(2)15-12(14)9-6-5-7-10-11(9)17-13(3,4)16-10/h5-8,10-11H,1-4H3/t10-,11+/m0/s1
InChIKey ZBKGQZBZSCNWJD-WDEREUQCSA-N
Literature Reference DOI 10.1039/c4ob01417k
Molecular Weight 238.283 g/mol
SMILES C1(C)(O[C@@]2([C@@](C(=CC=C2)C(=O)OC(C)C)(O1)[H])[H])C
SPLASH splash10-0079-4900000000-9e6db14a5b5b627ef4d6
Source of Spectrum F5-12-7816-25
Synonyms (3aR,7aS)-isopropyl 2,2-dimethyl-3a,7a-dihydrobenzo[d][1,3]dioxole-4-carboxylate
Wiley ID 1748293