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trans-4-(1-Propenyl)[2.2]paracyclophane
SpectraBase Compound ID BCMvApC9PHE
InChI InChI=1S/C19H20/c1-2-3-19-14-17-9-8-15-4-6-16(7-5-15)10-12-18(19)13-11-17/h2-7,11,13-14H,8-10,12H2,1H3/b3-2+
InChIKey WQPZXOKHWMQDDZ-NSCUHMNNSA-N
Mol Weight 248.37 g/mol
Molecular Formula C19H20
Exact Mass 248.156501 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 1RP7O5zHXM
Name trans-4-(1-Propenyl)[2.2]paracyclophane
Alternate Name(s) 5-[(1E)-1-propenyl]tricyclo[8.2.2.2(4,7)]hexadeca-1(12),4,6,10,13,15-hexaene
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C19H20
InChI InChI=1S/C19H20/c1-2-3-19-14-17-9-8-15-4-6-16(7-5-15)10-12-18(19)13-11-17/h2-7,11,13-14H,8-10,12H2,1H3/b3-2+
InChIKey WQPZXOKHWMQDDZ-NSCUHMNNSA-N
Molecular Weight 248.369 g/mol
SMILES c1(c2CCc3ccc(CCc(c1)cc2)cc3)\C=C\C
SPLASH splash10-002f-2910000000-f5422a9ac3073f09a11d
Source of Spectrum K1-2-344-16
Wiley ID 1588161