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1,3-Phenyl-3,4,6,7,8,8a-hexahydro-1H-isochromene-3-carboxylic acid methyl ester
SpectraBase Compound ID 8OVaDv2eJ5R
InChI InChI=1S/C17H20O3/c1-19-17(18)15-11-13-9-5-6-10-14(13)16(20-15)12-7-3-2-4-8-12/h2-4,7-9,14-16H,5-6,10-11H2,1H3
InChIKey QJGQTMBYAUXHRF-UHFFFAOYSA-N
Mol Weight 272.34 g/mol
Molecular Formula C17H20O3
Exact Mass 272.141245 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 8MT0CCUx65H
Name 1,3-Phenyl-3,4,6,7,8,8a-hexahydro-1H-isochromene-3-carboxylic acid methyl ester
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C17H20O3
InChI InChI=1S/C17H20O3/c1-19-17(18)15-11-13-9-5-6-10-14(13)16(20-15)12-7-3-2-4-8-12/h2-4,7-9,14-16H,5-6,10-11H2,1H3
InChIKey QJGQTMBYAUXHRF-UHFFFAOYSA-N
Molecular Weight 272.344 g/mol
SMILES C1(OC(CC2=CCCCC12)C(=O)OC)c1ccccc1
SPLASH splash10-0l0x-3950000000-107ef98ec43a98a21b09
Source of Spectrum SO-0-939-2
Synonyms 1-Phenyl-3,4,6,7,8,8a-hexahydro-1H-isochromene-3-carboxylic acid methyl ester Methyl 1-phenyl-3,4,6,7,8,8a-hexahydro-1H-2-benzopyran-3-carboxylate
Wiley ID 864956