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2-ACETYL-4a-HYDROXYOCTAHYDRO-6-OXO-1-VERATRYL-8a(1H)-ISOQUINOLINECARBOXYLIC ACID, METHYL ESTER
SpectraBase Compound ID H9HT3VvBKFj
InChI InChI=1S/C22H29NO7/c1-14(24)23-10-9-21(27)13-16(25)7-8-22(21,20(26)30-4)19(23)12-15-5-6-17(28-2)18(11-15)29-3/h5-6,11,19,27H,7-10,12-13H2,1-4H3
InChIKey YFKHUQIDCZQPDR-UHFFFAOYSA-N
Mol Weight 419.47 g/mol
Molecular Formula C22H29NO7
Exact Mass 419.194402 g/mol

Transmission Infrared (IR) Spectrum

Transmission Infrared (IR) Spectrum

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SpectraBase Spectrum ID IEocbhQ4ICo
Name 2-ACETYL-4a-HYDROXYOCTAHYDRO-6-OXO-1-VERATRYL-8a(1H)-ISOQUINOLINECARBOXYLIC ACID, METHYL ESTER
Source of Sample H. G. O. Becker, Technische Hochschule, Leuna-Merseburg, Germany
Copyright Copyright © 1980, 1981-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C22H29NO7
InChI InChI=1S/C22H29NO7/c1-14(24)23-10-9-21(27)13-16(25)7-8-22(21,20(26)30-4)19(23)12-15-5-6-17(28-2)18(11-15)29-3/h5-6,11,19,27H,7-10,12-13H2,1-4H3
InChIKey YFKHUQIDCZQPDR-UHFFFAOYSA-N
Literature Reference Abstract-Chemical Abstracts= 61, 641(1964)
Melting Point 165-166C
Molecular Weight 419.473999
Synonyms ISOQUINOLINECARBOXYLIC ACID, 8A/1H/-, 2-ACETYL-4A-HYDROXYOCTAHYDRO- 6-OXO-1-VERATRYL-, METHYL ESTER
Technique KBr WAFER