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

*Links on SpectraBase are not permalinks.
3-(7-Hydroxy-2,2-dimethyl-2H-chromen-6-yl)-propionic acid methyl ester
SpectraBase Compound ID DftCxiCkaAX
InChI InChI=1S/C15H18O4/c1-15(2)7-6-11-8-10(4-5-14(17)18-3)12(16)9-13(11)19-15/h6-9,16H,4-5H2,1-3H3
InChIKey FFFLKLNZALNBIB-UHFFFAOYSA-N
Mol Weight 262.3 g/mol
Molecular Formula C15H18O4
Exact Mass 262.120509 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 18MdKHIT18F
Name 3-(7-Hydroxy-2,2-dimethyl-2H-chromen-6-yl)-propionic acid methyl ester
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C15H18O4
InChI InChI=1S/C15H18O4/c1-15(2)7-6-11-8-10(4-5-14(17)18-3)12(16)9-13(11)19-15/h6-9,16H,4-5H2,1-3H3
InChIKey FFFLKLNZALNBIB-UHFFFAOYSA-N
Molecular Weight 262.305 g/mol
SMILES Oc1cc2OC(C)(C)C=Cc2cc1CCC(=O)OC
SPLASH splash10-014i-0290000000-f2408a0b216f61f8c8f9
Source of Spectrum F-67-499-7a
Synonyms 9,9-Dimethyl-6,7-pyrano-hydrocoumaric acid methyl ester 3-(7-hydroxy-2,2-dimethyl-1-benzopyran-6-yl)propanoic acid methyl ester Methyl 3-(7-hydroxy-2,2-dimethylchromen-6-yl)propanoate Methyl 3-(7-hydroxy-2,2-dimethyl-chromen-6-yl)propanoate Methyl 3-(2,2-dimethyl-7-oxidanyl-chromen-6-yl)propanoate
Wiley ID 1685468