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(1R,2S,5R)-2-isopropyl-5-methylcyclohexyl 6-hydroxy-2-methoxy-7,8-dihydroquinoline-5-carboxylate
SpectraBase Compound ID E6MpIt3PFPl
InChI InChI=1S/C21H29NO4/c1-12(2)14-6-5-13(3)11-18(14)26-21(24)20-15-7-10-19(25-4)22-16(15)8-9-17(20)23/h7,10,12-14,18,23H,5-6,8-9,11H2,1-4H3/t13-,14+,18-/m1/s1
InChIKey NDINCWNRJKZLJM-QWQRMKEZSA-N
Mol Weight 359.47 g/mol
Molecular Formula C21H29NO4
Exact Mass 359.209658 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID GOlVx4B2ARH
Name (1R,2S,5R)-2-isopropyl-5-methylcyclohexyl 6-hydroxy-2-methoxy-7,8-dihydroquinoline-5-carboxylate
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C21H29NO4
InChI InChI=1S/C21H29NO4/c1-12(2)14-6-5-13(3)11-18(14)26-21(24)20-15-7-10-19(25-4)22-16(15)8-9-17(20)23/h7,10,12-14,18,23H,5-6,8-9,11H2,1-4H3/t13-,14+,18-/m1/s1
InChIKey NDINCWNRJKZLJM-QWQRMKEZSA-N
Literature Reference DOI 10.1002/cjoc.20030210716
Molecular Weight 359.466 g/mol
SMILES OC1=C(c2ccc(nc2CC1)OC)C(=O)O[C@]1([C@@](CC[C@](C1)(C)[H])(C(C)C)[H])[H]
SPLASH splash10-0udi-3191000000-2e62b857ff9fe103ed7d
Source of Spectrum CJC-21-795-4a
Wiley ID 1773757