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1-[3-(ethoxycarbonyl)-2-hydroxypentyl]-6,7-dimethoxy-1,2-dihydroisoquinoline
SpectraBase Compound ID 6gGBXQ48trd
InChI InChI=1S/C19H27NO5/c1-5-13(19(22)25-6-2)16(21)11-15-14-10-18(24-4)17(23-3)9-12(14)7-8-20-15/h7-10,13,15-16,20-21H,5-6,11H2,1-4H3
InChIKey OGXXFZKQFPIVSL-UHFFFAOYSA-N
Mol Weight 349.43 g/mol
Molecular Formula C19H27NO5
Exact Mass 349.188923 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 764uGtZYcS1
Name 1-[3-(ethoxycarbonyl)-2-hydroxypentyl]-6,7-dimethoxy-1,2-dihydroisoquinoline
CAS Registry Number 93605-28-8
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C19H27NO5
InChI InChI=1S/C19H27NO5/c1-5-13(19(22)25-6-2)16(21)11-15-14-10-18(24-4)17(23-3)9-12(14)7-8-20-15/h7-10,13,15-16,20-21H,5-6,11H2,1-4H3
InChIKey OGXXFZKQFPIVSL-UHFFFAOYSA-N
Molecular Weight 349.427 g/mol
SMILES OC(CC1c2c(cc(c(c2)OC)OC)C=CN1)C(C(=O)OCC)CC
SPLASH splash10-0a4i-0192000000-b9faef3b84f0b3bbed3f
Source of Spectrum J-50-68-12
Synonyms Ethyl 4-(6,7-dimethoxy-1,2-dihydro-1-isoquinolinyl)-2-ethyl-3-hydroxybutanoate
Wiley ID 1341381