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1,3,6-tri(1-cyclohexenyl) 4-propenyl hex3-en-1,5-diyne
SpectraBase Compound ID 1LZxCn8Guif
InChI InChI=1S/C27H32/c1-2-12-25(21-19-23-13-6-3-7-14-23)27(26-17-10-5-11-18-26)22-20-24-15-8-4-9-16-24/h2,13,15,17H,1,3-12,14,16,18H2/b27-25+
InChIKey MYJZGWCZWLRPPK-IMVLJIQESA-N
Mol Weight 356.6 g/mol
Molecular Formula C27H32
Exact Mass 356.250401 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID DXLe8FE2aSn
Name 1,3,6-tri(1-cyclohexenyl) 4-propenyl hex3-en-1,5-diyne
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C27H32
InChI InChI=1S/C27H32/c1-2-12-25(21-19-23-13-6-3-7-14-23)27(26-17-10-5-11-18-26)22-20-24-15-8-4-9-16-24/h2,13,15,17H,1,3-12,14,16,18H2/b27-25+
InChIKey MYJZGWCZWLRPPK-IMVLJIQESA-N
Literature Reference DOI 10.1002/adsc.201000430
Molecular Weight 356.553 g/mol
SMILES C1(\C(C#CC2=CCCCC2)=C\(C#CC=2CCCCC2)CC=C)=CCCCC1
SPLASH splash10-016u-2791000000-f7925fc3071508cc4203
Source of Spectrum ASC-352-2887/SM15-15_2
Synonyms (Z)-1,1',1''-(4-allylhexa-3-en-1,5-diyne-1,3,6-triyl)tricyclohex-1-ene
Wiley ID 1764082