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(R)-3-(3-(Cyclopentyloxy)-4-methoxyphenyl)-4-nitrobutanal
SpectraBase Compound ID KnwFYYRVTvv
InChI InChI=1S/C16H21NO5/c1-21-15-7-6-12(13(8-9-18)11-17(19)20)10-16(15)22-14-4-2-3-5-14/h6-7,9-10,13-14H,2-5,8,11H2,1H3/t13-/m0/s1
InChIKey BBDORXDEXAYBJK-ZDUSSCGKSA-N
Mol Weight 307.35 g/mol
Molecular Formula C16H21NO5
Exact Mass 307.141973 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 1N6VTp2dwVt
Name (R)-3-(3-(Cyclopentyloxy)-4-methoxyphenyl)-4-nitrobutanal
Alternate Name(s) (3R)-3-(3-cyclopentyloxy-4-methoxyphenyl)-4-nitrobutanal (3R)-3-[3-(cyclopentoxy)-4-methoxy-phenyl]-4-nitro-butanal (3R)-3-(3-cyclopentyloxy-4-methoxy-phenyl)-4-nitro-butanal
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Formula C16H21NO5
InChI InChI=1S/C16H21NO5/c1-21-15-7-6-12(13(8-9-18)11-17(19)20)10-16(15)22-14-4-2-3-5-14/h6-7,9-10,13-14H,2-5,8,11H2,1H3/t13-/m0/s1
InChIKey BBDORXDEXAYBJK-ZDUSSCGKSA-N
Literature Reference DOI 10.1021/jo301506p
Molecular Weight 307.346 g/mol
SMILES c1(cc(c(cc1)OC)OC1CCCC1)[C@](C[N+](=O)[O-])(CC=O)[H]
SPLASH splash10-03di-1900000000-1acc6ca9a0a87e86b23c
Source of Spectrum J-77-8983-5k
Wiley ID 1747048