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Ethyl (E)-3-(5-Phenyl-1,2,3,6-tetrahydroazulen-6-yl)propenoate
SpectraBase Compound ID 7lqEOEpqeoE
InChI InChI=1S/C21H22O2/c1-2-23-21(22)14-13-18-12-11-16-9-6-10-19(16)15-20(18)17-7-4-3-5-8-17/h3-5,7-8,11-15,18H,2,6,9-10H2,1H3/b14-13+
InChIKey MGXNNGKSOISPOU-BUHFOSPRSA-N
Mol Weight 306.41 g/mol
Molecular Formula C21H22O2
Exact Mass 306.16198 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 7kFku6nm0nB
Name Ethyl (E)-3-(5-Phenyl-1,2,3,6-tetrahydroazulen-6-yl)propenoate
Alternate Name(s) Ethyl (2E)-3-(5-phenyl-1,2,3,6-tetrahydro-6-azulenyl)-2-propenoate
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C21H22O2
InChI InChI=1S/C21H22O2/c1-2-23-21(22)14-13-18-12-11-16-9-6-10-19(16)15-20(18)17-7-4-3-5-8-17/h3-5,7-8,11-15,18H,2,6,9-10H2,1H3/b14-13+
InChIKey MGXNNGKSOISPOU-BUHFOSPRSA-N
Molecular Weight 306.405 g/mol
SMILES C1=C(C(C=CC2=C1CCC2)\C=C\C(=O)OCC)c1ccccc1
SPLASH splash10-001l-0490000000-cb97089e92c7288e4685
Source of Spectrum C-116-6729-11
Wiley ID 1308649