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u-2-[1-(4-methoxyphenyl)-2-nitroethyl]-cyclohexanone
SpectraBase Compound ID 8gQqU6mn5rB
InChI InChI=1S/C15H19NO4/c1-20-12-8-6-11(7-9-12)14(10-16(18)19)13-4-2-3-5-15(13)17/h6-9,13-14H,2-5,10H2,1H3/t13?,14-/m1/s1
InChIKey FYWYIIZOPMFOGB-ARLHGKGLSA-N
Mol Weight 277.32 g/mol
Molecular Formula C15H19NO4
Exact Mass 277.131408 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID EdyIKeGzpZL
Name u-2-[1-(4-methoxyphenyl)-2-nitroethyl]-cyclohexanone
CAS Registry Number 99391-23-8
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C15H19NO4
InChI InChI=1S/C15H19NO4/c1-20-12-8-6-11(7-9-12)14(10-16(18)19)13-4-2-3-5-15(13)17/h6-9,13-14H,2-5,10H2,1H3/t13?,14-/m1/s1
InChIKey FYWYIIZOPMFOGB-ARLHGKGLSA-N
Molecular Weight 277.320 g/mol
SMILES C(N(=O)=O)[C@@](C1C(=O)CCCC1)(c1ccc(cc1)OC)[H]
SPLASH splash10-0f89-0980000000-90075af06781fdc7633a
Source of Spectrum I-65-847-0
Synonyms 2-[(1S)-1-(4-methoxyphenyl)-2-nitroethyl]cyclohexanone
Wiley ID 1281016