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(R)-Hepta-1',6'-dien-3'-ylbenzene

View entire compound with spectra: 1 MS (GC)

(R)-Hepta-1',6'-dien-3'-ylbenzene
SpectraBase Compound ID 2D5KlVEoDVS
InChI InChI=1S/C13H16/c1-3-5-9-12(4-2)13-10-7-6-8-11-13/h3-4,6-8,10-12H,1-2,5,9H2/t12-/m0/s1
InChIKey NSDJWLFVGIUNNT-LBPRGKRZSA-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 EI2hFoY8BDG
Name (R)-Hepta-1',6'-dien-3'-ylbenzene
Alternate Name(s) (R)-hepta-1,6-dien-3-ylbenzene [(3R)-hepta-1,6-dien-3-yl]benzene
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C13H16
InChI InChI=1S/C13H16/c1-3-5-9-12(4-2)13-10-7-6-8-11-13/h3-4,6-8,10-12H,1-2,5,9H2/t12-/m0/s1
InChIKey NSDJWLFVGIUNNT-LBPRGKRZSA-N
Literature Reference DOI 10.1002/adsc.201000213
Molecular Weight 172.271 g/mol
SMILES c1cccc(c1)[C@@](C=C)(CCC=C)[H]
SPLASH splash10-014i-3900000000-39df7685cbbc24a959c2
Source of Spectrum ASC-352-2023/SM30-32a
Wiley ID 1763915