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trans-3,4-Dihydro-2,2-dimethyl-5-nitro-4-(piperidin-1-yl)-2H-1-benzopyran-3-ol
SpectraBase Compound ID I10avpCpKPj
InChI InChI=1S/C16H22N2O4/c1-16(2)15(19)14(17-9-4-3-5-10-17)13-11(18(20)21)7-6-8-12(13)22-16/h6-8,14-15,19H,3-5,9-10H2,1-2H3/t14-,15+/m0/s1
InChIKey KROHYZJJYLPALH-LSDHHAIUSA-N
Mol Weight 306.36 g/mol
Molecular Formula C16H22N2O4
Exact Mass 306.157957 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID Eto9P0pb1dE
Name trans-3,4-Dihydro-2,2-dimethyl-5-nitro-4-(piperidin-1-yl)-2H-1-benzopyran-3-ol
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C16H22N2O4
InChI InChI=1S/C16H22N2O4/c1-16(2)15(19)14(17-9-4-3-5-10-17)13-11(18(20)21)7-6-8-12(13)22-16/h6-8,14-15,19H,3-5,9-10H2,1-2H3/t14-,15+/m0/s1
InChIKey KROHYZJJYLPALH-LSDHHAIUSA-N
Molecular Weight 306.362 g/mol
SMILES O[C@@]1([C@](c2c(OC1(C)C)cccc2N(=O)=O)(N1CCCCC1)[H])[H]
SPLASH splash10-001i-9420000000-b93fcd4365ecf2ff9aac
Source of Spectrum O-20-442-35
Synonyms (3R,4S)-2,2-dimethyl-5-nitro-4-(1-piperidinyl)-3,4-dihydro-2H-chromen-3-ol
Wiley ID 1307982