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4H-1-benzopyran-3-carboxylic acid-2-iso-propyl-ethyl ester
SpectraBase Compound ID 97LoXKQzm37
InChI InChI=1S/C15H18O3/c1-4-17-15(16)12-9-11-7-5-6-8-13(11)18-14(12)10(2)3/h5-8,10H,4,9H2,1-3H3
InChIKey FBFZBKLINJJZCO-UHFFFAOYSA-N
Mol Weight 246.31 g/mol
Molecular Formula C15H18O3
Exact Mass 246.125594 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID GYb35MgobTn
Name 4H-1-benzopyran-3-carboxylic acid-2-iso-propyl-ethyl ester
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C15H18O3
InChI InChI=1S/C15H18O3/c1-4-17-15(16)12-9-11-7-5-6-8-13(11)18-14(12)10(2)3/h5-8,10H,4,9H2,1-3H3
InChIKey FBFZBKLINJJZCO-UHFFFAOYSA-N
Literature Reference DOI 10.1021/ol200347g
Molecular Weight 246.306 g/mol
SMILES c1ccc2OC(=C(Cc2c1)C(OCC)=O)C(C)C
SPLASH splash10-006t-1960000000-6e4c717a22372fcb6fa1
Source of Spectrum A1-13-1972/SMS21-3j
Synonyms Ethyl 2-isopropyl-4H-chromene-3-carboxylate
Wiley ID 1753019