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Methyl (1S,3S and 1R,3S)-1-(2,2-dimethoxyethyl)-1,2,3,4-tetrahydrocarboline-3-carboxylate
SpectraBase Compound ID IphtBoXafQQ
InChI InChI=1S/C17H22N2O4/c1-21-15(22-2)9-13-16-11(8-14(18-13)17(20)23-3)10-6-4-5-7-12(10)19-16/h4-7,13-15,18-19H,8-9H2,1-3H3
InChIKey BLEIXJSAQVSRQO-UHFFFAOYSA-N
Mol Weight 318.37 g/mol
Molecular Formula C17H22N2O4
Exact Mass 318.157957 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID KVveNVNkZiV
Name Methyl (1S,3S and 1R,3S)-1-(2,2-dimethoxyethyl)-1,2,3,4-tetrahydrocarboline-3-carboxylate
Alternate Name(s) Methyl 1-(2,2-dimethoxyethyl)-2,3,4,9-tetrahydro-1H-pyrido[3,4-b]indole-3-carboxylate
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Formula C17H22N2O4
InChI InChI=1S/C17H22N2O4/c1-21-15(22-2)9-13-16-11(8-14(18-13)17(20)23-3)10-6-4-5-7-12(10)19-16/h4-7,13-15,18-19H,8-9H2,1-3H3
InChIKey BLEIXJSAQVSRQO-UHFFFAOYSA-N
Literature Reference DOI 10.1002_(SICI)1521-3897(199910)341_7_677
Molecular Weight 318.373 g/mol
SMILES [nH]1c2C(NC(Cc2c2ccccc12)C(OC)=O)CC(OC)OC
SPLASH splash10-00or-4793000000-9437af33fa3199a4976b
Source of Spectrum JF-341-679-3
Wiley ID 1766775