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1H-Inden-1-ol, 3a,4,5,6,7,7a-hexahydro-1-methyl-2-(4-morpholinyl)-7a-nitro-, (1.alpha.,3a.alpha.,7a.alpha.)-
SpectraBase Compound ID 7MvwVk68Cly
InChI InChI=1S/C14H22N2O4/c1-13(17)12(15-6-8-20-9-7-15)10-11-4-2-3-5-14(11,13)16(18)19/h10-11,17H,2-9H2,1H3/t11-,13-,14+/m1/s1
InChIKey VBUMLRJCARZBRH-BNOWGMLFSA-N
Mol Weight 282.34 g/mol
Molecular Formula C14H22N2O4
Exact Mass 282.157957 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 6kvYEBZhheB
Name 1H-Inden-1-ol, 3a,4,5,6,7,7a-hexahydro-1-methyl-2-(4-morpholinyl)-7a-nitro-, (1.alpha.,3a.alpha.,7a.alpha.)-
CAS Registry Number 121590-96-3
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C14H22N2O4
InChI InChI=1S/C14H22N2O4/c1-13(17)12(15-6-8-20-9-7-15)10-11-4-2-3-5-14(11,13)16(18)19/h10-11,17H,2-9H2,1H3/t11-,13-,14+/m1/s1
InChIKey VBUMLRJCARZBRH-BNOWGMLFSA-N
Molecular Weight 282.340 g/mol
SMILES O[C@]1([C@@]2(N(=O)=O)[C@@](C=C1N1CCOCC1)(CCCC2)[H])C
SPLASH splash10-0006-9110000000-83406e7a21a075ac527b
Source of Spectrum F-44-6927-7
Synonyms (1R,3aR,7aS)-1-methyl-2-(4-morpholinyl)-7a-nitro-3a,4,5,6,7,7a-hexahydro-1H-inden-1-ol [1R*-(1.alpha.,3a.alpha.,7a.alpha.)]-3a,4,5,6,7,7a-hexahydro-1-hydroxy-1-methyl-2(4-morpholinyl)-7a-nitro-1H-indene
Wiley ID 1285683