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1-pentyl-4-(vinyl-d3)benzene
SpectraBase Compound ID GCPcLnNdxMT
InChI InChI=1S/C13H18/c1-3-5-6-7-13-10-8-12(4-2)9-11-13/h4,8-11H,2-3,5-7H2,1H3/i2D2,4D
InChIKey ADOYKPDOFQXKEF-OVLJBECYSA-N
Mol Weight 177.31 g/mol
Molecular Formula C13H15D3
Exact Mass 177.159681 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID Hcg0XujR5Kr
Name 1-pentyl-4-(vinyl-d3)benzene
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 177.159680817 u
Formula C13H15D3
GC Column HP-5 (30 m ?? 320 micrometer, film thickness 0.25 micrometer)
GC Oven Program Oven temp 250oC
InChI InChI=1S/C13H18/c1-3-5-6-7-13-10-8-12(4-2)9-11-13/h4,8-11H,2-3,5-7H2,1H3/i2D2,4D
InChIKey ADOYKPDOFQXKEF-OVLJBECYSA-N
Instrument Name Agilent 7890
Ionization Type EI
Literature Reference DOI 10.1002/anie.202216511
Molecular Weight 177.305 g/mol
Quality 349
SMILES C(=C([D])[D])(C1=CC=C(C=C1)CCCCC)[D]
SPLASH splash10-00di-0900000000-a64e9bc98dc99095ec3e
Source of Spectrum ACI-62-SM59-2g (DOI: 10.1002/anie.202216511)
Wiley ID 1908436