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Picene, 1,2-dihydro-9,?,?-trimethyl-

View entire compound with spectra: 1 MS (GC)

Picene, 1,2-dihydro-9,?,?-trimethyl-
SpectraBase Compound ID AnReR3PHBZg
InChI InChI=1S/C25H22/c1-3-17-7-8-18-9-10-21-23-12-11-19-16(2)5-4-6-20(19)22(23)13-14-24(21)25(18)15-17/h4-7,9-14H,3,8,15H2,1-2H3
InChIKey IIUSLLVDODNEQN-UHFFFAOYSA-N
Mol Weight 322.45 g/mol
Molecular Formula C25H22
Exact Mass 322.172151 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID IZxQaCQY7u4
Name Picene, 1,2-dihydro-9,?,?-trimethyl-
CAS Registry Number 105167-66-6
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C25H22
InChI InChI=1S/C25H22/c1-3-17-7-8-18-9-10-21-23-12-11-19-16(2)5-4-6-20(19)22(23)13-14-24(21)25(18)15-17/h4-7,9-14H,3,8,15H2,1-2H3
InChIKey IIUSLLVDODNEQN-UHFFFAOYSA-N
Molecular Weight 322.451 g/mol
SMILES c12c(c3ccc4c(c3cc2)cccc4C)ccc2c1CC(=CC2)CC
SPLASH splash10-0abc-0029000000-51b59449820e8947aae7
Source of Spectrum JC-367-128-53
Synonyms 2-Ethyl-9-methyl-1,4-dihydropicene 2-Ethyl-9-methyl-1-hydro-picene
Wiley ID 1322236