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1-Methoxy-4-[(3'R,4'R)-4'-nitrohex-1'-en-3'-yl]benzene

View entire compound with spectra: 1 MS (GC)

1-Methoxy-4-[(3'R,4'R)-4'-nitrohex-1'-en-3'-yl]benzene
SpectraBase Compound ID JQnDYfXrsA3
InChI InChI=1S/C13H17NO3/c1-4-12(13(5-2)14(15)16)10-6-8-11(17-3)9-7-10/h4,6-9,12-13H,1,5H2,2-3H3/t12-,13-/m1/s1
InChIKey DDOAGOVBVRGDOT-CHWSQXEVSA-N
Mol Weight 235.28 g/mol
Molecular Formula C13H17NO3
Exact Mass 235.120843 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID DjivgGmMyxV
Name 1-Methoxy-4-[(3'R,4'R)-4'-nitrohex-1'-en-3'-yl]benzene
Alternate Name(s) 1-Methoxy-4-((3R,4R)-4-nitrohex-1-en-3-yl)benzene 1-Methoxy-4-[(1R,2R)-2-nitro-1-vinyl-butyl]benzene 1-Methoxy-4-[(3R,4R)-4-nitrohex-1-en-3-yl]benzene
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Formula C13H17NO3
InChI InChI=1S/C13H17NO3/c1-4-12(13(5-2)14(15)16)10-6-8-11(17-3)9-7-10/h4,6-9,12-13H,1,5H2,2-3H3/t12-,13-/m1/s1
InChIKey DDOAGOVBVRGDOT-CHWSQXEVSA-N
Literature Reference DOI 10.1021/jo400663d
Molecular Weight 235.283 g/mol
SMILES c1cc(ccc1OC)[C@]([C@]([N+](=O)[O-])(CC)[H])(C=C)[H]
SPLASH splash10-0002-4900000000-dd01338f54efc882810a
Source of Spectrum J-78-6506-2f
Wiley ID 1745520