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8H-Pyrano[2,3-h]quinoline-2-carboxylic acid, 4-chloro-9,10-dihydro-5-methoxy-8,8-dimethyl-3-(2-oxopropyl)-, methyl ester
SpectraBase Compound ID p1hS33m10n
InChI InChI=1S/C20H22ClNO5/c1-10(23)8-12-16(21)15-14(25-4)9-13-11(6-7-20(2,3)27-13)17(15)22-18(12)19(24)26-5/h9H,6-8H2,1-5H3
InChIKey UMSXUZJYNZJSHJ-UHFFFAOYSA-N
Mol Weight 391.85 g/mol
Molecular Formula C20H22ClNO5
Exact Mass 391.118651 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 2u7yZbBHrpg
Name 8H-Pyrano[2,3-h]quinoline-2-carboxylic acid, 4-chloro-9,10-dihydro-5-methoxy-8,8-dimethyl-3-(2-oxopropyl)-, methyl ester
Alternate Name(s) Methyl 4-chloro-5-methoxy-8,8-dimethyl-3-(2-oxopropyl)-9,10-dihydro-8H-pyrano[2,3-h]quinoline-2-carboxylate Methyl ester of 3-acetonyl-4-chloro-5-methoxy-8,8-dimethyl-9,10-dihydro-8H-pyrano(2,3-h)quinolin-2-carboxylic acid
CAS Registry Number 66385-23-7
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C20H22ClNO5
InChI InChI=1S/C20H22ClNO5/c1-10(23)8-12-16(21)15-14(25-4)9-13-11(6-7-20(2,3)27-13)17(15)22-18(12)19(24)26-5/h9H,6-8H2,1-5H3
InChIKey UMSXUZJYNZJSHJ-UHFFFAOYSA-N
Molecular Weight 391.851 g/mol
SMILES c12c(nc(c(c2Cl)CC(=O)C)C(=O)OC)c2CCC(Oc2cc1OC)(C)C
SPLASH splash10-0007-0009000000-d57dc7c3c2e8dd97fbfd
Source of Spectrum K-111-448-0
Wiley ID 1365319