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Methyl 7-{2-[2-(Methoxy-carbonyl)ethyl]phenyl}cyclohepta-1,3-diene-1-carboxylate
SpectraBase Compound ID HKdaPSh0aHz
InChI InChI=1S/C19H22O4/c1-22-18(20)13-12-14-8-6-7-9-15(14)16-10-4-3-5-11-17(16)19(21)23-2/h3,5-9,11,16H,4,10,12-13H2,1-2H3
InChIKey XOLRSMMQWPUZLU-UHFFFAOYSA-N
Mol Weight 314.38 g/mol
Molecular Formula C19H22O4
Exact Mass 314.151809 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID rYuAj7Zfk
Name Methyl 7-{2-[2-(Methoxy-carbonyl)ethyl]phenyl}cyclohepta-1,3-diene-1-carboxylate
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C19H22O4
InChI InChI=1S/C19H22O4/c1-22-18(20)13-12-14-8-6-7-9-15(14)16-10-4-3-5-11-17(16)19(21)23-2/h3,5-9,11,16H,4,10,12-13H2,1-2H3
InChIKey XOLRSMMQWPUZLU-UHFFFAOYSA-N
Literature Reference DOI 10.1002/hlca.19970800506
Molecular Weight 314.381 g/mol
SMILES C=1(C(CCC=CC1)c1c(cccc1)CCC(=O)OC)C(OC)=O
SPLASH splash10-015a-1941000000-9fe727ad52ac7b4dc507
Source of Spectrum H-80-1398-1398_3
Synonyms Methyl 7-(2-(3-methoxy-3-oxopropyl)phenyl)cyclohepta-1,3-diene-1-carboxylate
Wiley ID 1785292