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2-[1-(1,1,2,2,2-pentadeuterioethyl)cyclopropyl]vinyl]benzene
SpectraBase Compound ID 5IQFL5qJpit
InChI InChI=1S/C13H16/c1-2-13(10-11-13)9-8-12-6-4-3-5-7-12/h3-9H,2,10-11H2,1H3/i1D3,2D2
InChIKey FJEOOGKIABNDIK-ZBJDZAJPSA-N
Mol Weight 177.3 g/mol
Molecular Formula C13H11D5
Exact Mass 177.156584 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID B6SJoFKvdUC
Name 2-[1-(1,1,2,2,2-pentadeuterioethyl)cyclopropyl]vinyl]benzene
Alternate Name(s) (2-(1-(ethyl-d5)cyclopropyl)vinyl)benzene
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C13H11D5
InChI InChI=1S/C13H16/c1-2-13(10-11-13)9-8-12-6-4-3-5-7-12/h3-9H,2,10-11H2,1H3/i1D3,2D2
InChIKey FJEOOGKIABNDIK-ZBJDZAJPSA-N
Literature Reference DOI 10.1002/adsc.201600357
Molecular Weight 177.302 g/mol
SMILES C1(CC1)(C(C([D])([D])[D])([D])[D])C=Cc1ccccc1
SPLASH splash10-0006-1900000000-a45593b396042c8f691e
Source of Spectrum ASC-358-2398/SM16-[D5]_18
Wiley ID 1807517