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

*Links on SpectraBase are not permalinks.
1-[(E)-pent-1-enyl]-1,3-dihydroisobenzofuran-4-carboxylic acid methyl ester
SpectraBase Compound ID IuIT1b3j4se
InChI InChI=1S/C15H18O3/c1-3-4-5-9-14-11-7-6-8-12(15(16)17-2)13(11)10-18-14/h5-9,14H,3-4,10H2,1-2H3/b9-5+
InChIKey AIVREXMIDUBVNA-WEVVVXLNSA-N
Mol Weight 246.31 g/mol
Molecular Formula C15H18O3
Exact Mass 246.125594 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 hWCnrxhnCX
Name 1-[(E)-pent-1-enyl]-1,3-dihydroisobenzofuran-4-carboxylic acid methyl ester
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C15H18O3
InChI InChI=1S/C15H18O3/c1-3-4-5-9-14-11-7-6-8-12(15(16)17-2)13(11)10-18-14/h5-9,14H,3-4,10H2,1-2H3/b9-5+
InChIKey AIVREXMIDUBVNA-WEVVVXLNSA-N
Molecular Weight 246.306 g/mol
SMILES C1(OCc2c1cccc2C(=O)OC)\C=C\CCC
SPLASH splash10-0udi-0190000000-9413f4fb2e8aa954782e
Source of Spectrum J-65-8110-8
Synonyms 1-[(E)-pent-1-enyl]phthalan-4-carboxylic acid methyl ester Methyl 1-[(E)-pent-1-enyl]-1,3-dihydro-2-benzofuran-4-carboxylate Methyl 1-[(E)-pent-1-enyl]-1,3-dihydroisobenzofuran-4-carboxylate
Wiley ID 1533830