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Dimethyl-isopropyl-dibenzo[a,c]cyclooctatetraene
SpectraBase Compound ID 3yfV3iBsJ6I
InChI InChI=1S/C21H22/c1-14(2)18-12-11-17-9-5-7-15(3)20(17)21-16(4)8-6-10-19(21)13-18/h5-14H,1-4H3/b12-11-,17-11-,18-12+,18-13+,19-13-,21-20-
InChIKey VOCGZNYSSRJLGI-QXMRUVSHSA-N
Mol Weight 274.41 g/mol
Molecular Formula C21H22
Exact Mass 274.172151 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 7DX8WKLHe3p
Name Dimethyl-isopropyl-dibenzo[a,c]cyclooctatetraene
CAS Registry Number 127709-89-1
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C21H22
InChI InChI=1S/C21H22/c1-14(2)18-12-11-17-9-5-7-15(3)20(17)21-16(4)8-6-10-19(21)13-18/h5-14H,1-4H3/b12-11-,17-11-,18-12+,18-13+,19-13-,21-20-
InChIKey VOCGZNYSSRJLGI-QXMRUVSHSA-N
Molecular Weight 274.407 g/mol
SMILES c12\C=C/(\C=C/c3c(-c2c(C)ccc1)c(ccc3)C)C(C)C
SPLASH splash10-001i-0090000000-b257d5a5ba9c5c9c1c2d
Source of Spectrum K-123-2367-2
Wiley ID 1278784