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trans-4-[2-(2-methylphenyl)ethenyl]-5-oxatetracyclo[6.6.1.0(2,6).0(9,14)]pentadeca-2(6),3,9,11,13-pentaene
SpectraBase Compound ID JIL7IzeN8IU
InChI InChI=1S/C23H20O/c1-15-6-2-3-7-16(15)10-11-18-14-22-21-12-17(13-23(22)24-18)19-8-4-5-9-20(19)21/h2-11,14,17,21H,12-13H2,1H3/b11-10+/t17-,21+/m1/s1
InChIKey MXCPAKBKPSLLED-WXTJUASOSA-N
Mol Weight 312.41 g/mol
Molecular Formula C23H20O
Exact Mass 312.151415 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID Cq55JzSOuvk
Name trans-4-[2-(2-methylphenyl)ethenyl]-5-oxatetracyclo[6.6.1.0(2,6).0(9,14)]pentadeca-2(6),3,9,11,13-pentaene
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C23H20O
InChI InChI=1S/C23H20O/c1-15-6-2-3-7-16(15)10-11-18-14-22-21-12-17(13-23(22)24-18)19-8-4-5-9-20(19)21/h2-11,14,17,21H,12-13H2,1H3/b11-10+/t17-,21+/m1/s1
InChIKey MXCPAKBKPSLLED-WXTJUASOSA-N
Molecular Weight 312.412 g/mol
SMILES c12c(oc(c2)\C=C\c2c(C)cccc2)C[C@]2(C[C@]1(c1c2cccc1)[H])[H]
SPLASH splash10-03di-0009000000-0d2cc6c0e0fe2d1c4cdd
Source of Spectrum F-66-9411-7b
Wiley ID 1685114