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1-(6-methyloct-1,3,5-trien-7-ynyl)-3-(8-methyldeca-1,3,5,7-tetraen-9-ynyl)benzene
SpectraBase Compound ID 99oONoBWwyO
InChI InChI=1S/C26H24/c1-5-23(3)16-11-8-7-9-13-18-25-20-15-21-26(22-25)19-14-10-12-17-24(4)6-2/h1-2,7-22H,3-4H3/b9-7+,11-8+,12-10+,18-13-,19-14+,23-16-,24-17-
InChIKey LSKHXEVSNOFPIQ-WFOMMRJISA-N
Mol Weight 336.48 g/mol
Molecular Formula C26H24
Exact Mass 336.187801 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 4xyWKWCm4Q2
Name 1-(6-methyloct-1,3,5-trien-7-ynyl)-3-(8-methyldeca-1,3,5,7-tetraen-9-ynyl)benzene
CAS Registry Number 111220-99-6
Comments Less than 3 mono-isotopic peaks
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C26H24
InChI InChI=1S/C26H24/c1-5-23(3)16-11-8-7-9-13-18-25-20-15-21-26(22-25)19-14-10-12-17-24(4)6-2/h1-2,7-22H,3-4H3/b9-7+,11-8+,12-10+,18-13-,19-14+,23-16-,24-17-
InChIKey LSKHXEVSNOFPIQ-WFOMMRJISA-N
Molecular Weight 336.478 g/mol
SMILES C(#C)\C(=C/C=C/C=C/C=C\c1cc(\C=C\C=C\C=C/(C#C)C)ccc1)C
SPLASH splash10-004r-9006000000-991db06cb0c3712b12e7
Source of Spectrum KC-1987-842-20
Synonyms 1-[(1Z,3E,5E,7Z)-8-methyl-1,3,5,7-decatetraen-9-ynyl]-3-[(1E,3E,5Z)-6-methyl-1,3,5-octatrien-7-ynyl]benzene
Wiley ID 1332881