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(1S,3S)-1-Methyl-1,2,3,4-tetrahydro-.beta.-carboline-3-carboxylic acid methyl ester
SpectraBase Compound ID J10BMq98QbB
InChI InChI=1S/C14H16N2O2/c1-8-13-10(7-12(15-8)14(17)18-2)9-5-3-4-6-11(9)16-13/h3-6,8,12,15-16H,7H2,1-2H3/t8-,12-/m0/s1
InChIKey WZHYQHKXXRMALW-UFBFGSQYSA-N
Mol Weight 244.29 g/mol
Molecular Formula C14H16N2O2
Exact Mass 244.121178 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID JWr6kapsAzt
Name (1S,3S)-1-Methyl-1,2,3,4-tetrahydro-.beta.-carboline-3-carboxylic acid methyl ester
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C14H16N2O2
InChI InChI=1S/C14H16N2O2/c1-8-13-10(7-12(15-8)14(17)18-2)9-5-3-4-6-11(9)16-13/h3-6,8,12,15-16H,7H2,1-2H3/t8-,12-/m0/s1
InChIKey WZHYQHKXXRMALW-UFBFGSQYSA-N
Instrument Name HP G1800A GCD or VG 12-250
Ionization Type EI
Literature Reference DOI 10.1002_(SICI)1097-0231(19970422)11_7_762
Molecular Weight 244.294 g/mol
SMILES N1[C@](c2c(C[C@]1(C(=O)OC)[H])c1c([nH]2)cccc1)(C)[H]
SPLASH splash10-0aor-0920000000-af55f2a4327af913cd08
Sample Comments Diastereomeric mixture (9:1)
Source of Spectrum RCM-11-765-3c
Wiley ID 1837583