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2-(2-nitro-1-phenylethyl)hexanal

View entire compound with spectra: 1 MS (GC)

2-(2-nitro-1-phenylethyl)hexanal
SpectraBase Compound ID 71fg1b4HeOs
InChI InChI=1S/C14H19NO3/c1-2-3-7-13(11-16)14(10-15(17)18)12-8-5-4-6-9-12/h4-6,8-9,11,13-14H,2-3,7,10H2,1H3
InChIKey CAVOCKLMUFETBT-UHFFFAOYSA-N
Mol Weight 249.31 g/mol
Molecular Formula C14H19NO3
Exact Mass 249.136493 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 21o8tIt8YS
Name 2-(2-nitro-1-phenylethyl)hexanal
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C14H19NO3
InChI InChI=1S/C14H19NO3/c1-2-3-7-13(11-16)14(10-15(17)18)12-8-5-4-6-9-12/h4-6,8-9,11,13-14H,2-3,7,10H2,1H3
InChIKey CAVOCKLMUFETBT-UHFFFAOYSA-N
Literature Reference DOI 10.1002/adsc.201701627
Molecular Weight 249.310 g/mol
SMILES c1cc(ccc1)C(C[N+]([O-])=O)C(C=O)CCCC
SPLASH splash10-0f6y-5900000000-5abad5856728ceb83889
Source of Spectrum ASC-360-SM8-3d
Wiley ID 1811823