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Benzene, 6-heptynyl-

View entire compound with spectra: 1 MS (GC)

Benzene, 6-heptynyl-
SpectraBase Compound ID 8w74gVn0KRS
InChI InChI=1S/C13H16/c1-2-3-4-5-7-10-13-11-8-6-9-12-13/h1,6,8-9,11-12H,3-5,7,10H2
InChIKey QNHLQVQSWWKZTF-UHFFFAOYSA-N
Mol Weight 172.27 g/mol
Molecular Formula C13H16
Exact Mass 172.125201 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID LA6Ar6Uripa
Name Benzene, 6-heptynyl-
Alternate Name(s) 6-Heptynylbenzene Hept-6-ynylbenzene
CAS Registry Number 56293-02-8
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C13H16
InChI InChI=1S/C13H16/c1-2-3-4-5-7-10-13-11-8-6-9-12-13/h1,6,8-9,11-12H,3-5,7,10H2
InChIKey QNHLQVQSWWKZTF-UHFFFAOYSA-N
Molecular Weight 172.271 g/mol
SMILES C#CCCCCCc1ccccc1
SPLASH splash10-0006-9800000000-eecd6b9c0e884d449759
Source of Spectrum SD-1981-0-0
Wiley ID 1169470