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trans,trans-Cyclotrideca-1,5-dien-9-yne
SpectraBase Compound ID BZQJ2ztlwyz
InChI InChI=1S/C13H18/c1-2-4-6-8-10-12-13-11-9-7-5-3-1/h1-2,7,9H,3-6,8,11,13H2/b2-1+,9-7+
InChIKey IIFKDASAVNQLSJ-ATTBXNPTSA-N
Mol Weight 174.29 g/mol
Molecular Formula C13H18
Exact Mass 174.140851 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID BAHpO9sS6nf
Name trans,trans-Cyclotrideca-1,5-dien-9-yne
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C13H18
InChI InChI=1S/C13H18/c1-2-4-6-8-10-12-13-11-9-7-5-3-1/h1-2,7,9H,3-6,8,11,13H2/b2-1+,9-7+
InChIKey IIFKDASAVNQLSJ-ATTBXNPTSA-N
Molecular Weight 174.287 g/mol
SMILES C1#CCCC\C=C\CC\C=C\CC1
SPLASH splash10-000x-6900000000-2702c947d31934b7fd22
Source of Spectrum SO-0-344-4
Synonyms 1,5-cyclotridecadien-9-yne
Wiley ID 1538457