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

*Links on SpectraBase are not permalinks.
2-[1-(3-iodopropyl)-3-keto-phthalan-1-yl]acetic acid tert-butyl ester
SpectraBase Compound ID 9hAVu3oPuVY
InChI InChI=1S/C17H21IO4/c1-16(2,3)21-14(19)11-17(9-6-10-18)13-8-5-4-7-12(13)15(20)22-17/h4-5,7-8H,6,9-11H2,1-3H3
InChIKey IEXHRFWHYJKIBH-UHFFFAOYSA-N
Mol Weight 416.26 g/mol
Molecular Formula C17H21IO4
Exact Mass 416.048454 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 52quWJEq6Wz
Name 2-[1-(3-iodopropyl)-3-keto-phthalan-1-yl]acetic acid tert-butyl ester
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C17H21IO4
InChI InChI=1S/C17H21IO4/c1-16(2,3)21-14(19)11-17(9-6-10-18)13-8-5-4-7-12(13)15(20)22-17/h4-5,7-8H,6,9-11H2,1-3H3
InChIKey IEXHRFWHYJKIBH-UHFFFAOYSA-N
Molecular Weight 416.255 g/mol
SMILES C1(OC(=O)c2c1cccc2)(CC(OC(C)(C)C)=O)CCCI
SPLASH splash10-0a4i-9046000000-323295201a4e5fe2abc8
Source of Spectrum F-47-5449-17
Synonyms 2-[1-(3-iodopropyl)-3-oxo-1-isobenzofuranyl]acetic acid tert-butyl ester tert-Butyl 2-[1-(3-iodanylpropyl)-3-oxidanylidene-2-benzofuran-1-yl]ethanoate tert-Butyl 2-[1-(3-iodopropyl)-3-oxo-2-benzofuran-1-yl]acetate tert-Butyl 2-[1-(3-iodopropyl)-3-oxo-isobenzofuran-1-yl]acetate
Wiley ID 1376186