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1-Isopropyl-2,3,4,9-tetrahydro-1H-beta-carboline-3-carboxylic acid

View entire compound with spectra: 1 NMR

1-Isopropyl-2,3,4,9-tetrahydro-1H-beta-carboline-3-carboxylic acid
SpectraBase Compound ID 5X6yPesJbWu
InChI InChI=1S/C15H18N2O2/c1-8(2)13-14-10(7-12(17-13)15(18)19)9-5-3-4-6-11(9)16-14/h3-6,8,12-13,16-17H,7H2,1-2H3,(H,18,19)
InChIKey PQJWDNCGZBQHRJ-UHFFFAOYSA-N
Mol Weight 258.32 g/mol
Molecular Formula C15H18N2O2
Exact Mass 258.136828 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID Aa6EOJEpt9P
Name 1-Isopropyl-2,3,4,9-tetrahydro-1H-beta-carboline-3-carboxylic acid
Comments Computed using HOSE algorithm
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 258.136827826 u
Formula C15H18N2O2
InChI InChI=1S/C15H18N2O2/c1-8(2)13-14-10(7-12(17-13)15(18)19)9-5-3-4-6-11(9)16-14/h3-6,8,12-13,16-17H,7H2,1-2H3,(H,18,19)
InChIKey PQJWDNCGZBQHRJ-UHFFFAOYSA-N
Molecular Weight 258.321 g/mol
SMILES C1=2NC3=C(C2C=CC=C1)CC(NC3C(C)C)C(=O)O