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Methyl 2-(m-propoxyphenyl)bicyclo[4.4.1]undeca-1,3,5,7,9-pentaen-11-carboxylate
SpectraBase Compound ID 513Pet6uNEc
InChI InChI=1S/C22H22O3/c1-3-14-25-18-11-6-10-17(15-18)19-13-7-9-16-8-4-5-12-20(19)21(16)22(23)24-2/h4-13,15,21H,3,14H2,1-2H3
InChIKey BEFYAJKIKAJTDE-UHFFFAOYSA-N
Mol Weight 334.42 g/mol
Molecular Formula C22H22O3
Exact Mass 334.156895 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID KILTXjSXokL
Name Methyl 2-(m-propoxyphenyl)bicyclo[4.4.1]undeca-1,3,5,7,9-pentaen-11-carboxylate
Alternate Name(s) Methyl 2-(3-propoxyphenyl)bicyclo[4.4.1]undeca-1,3,5,7,9-pentaene-11-carboxylate
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C22H22O3
InChI InChI=1S/C22H22O3/c1-3-14-25-18-11-6-10-17(15-18)19-13-7-9-16-8-4-5-12-20(19)21(16)22(23)24-2/h4-13,15,21H,3,14H2,1-2H3
InChIKey BEFYAJKIKAJTDE-UHFFFAOYSA-N
Molecular Weight 334.415 g/mol
SMILES C12=C(c3cc(OCCC)ccc3)C=CC=C(C1C(=O)OC)C=CC=C2
SPLASH splash10-0059-0291000000-e3c550a25c5949860eb6
Source of Spectrum UW-0-0-16914
Wiley ID 1331378