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1H-Pyrido[3,4-b]indole, 2,3,4,9-tetrahydro-2-hydroxy-1,3-dimethyl-, cis-
SpectraBase Compound ID 8VgzoTyyXby
InChI InChI=1S/C13H16N2O/c1-8-7-11-10-5-3-4-6-12(10)14-13(11)9(2)15(8)16/h3-6,8-9,14,16H,7H2,1-2H3/t8-,9+/m1/s1
InChIKey ZBKKVADAUYULII-BDAKNGLRSA-N
Mol Weight 216.28 g/mol
Molecular Formula C13H16N2O
Exact Mass 216.126263 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 4Yqzg0I3621
Name 1H-Pyrido[3,4-b]indole, 2,3,4,9-tetrahydro-2-hydroxy-1,3-dimethyl-, cis-
Alternate Name(s) (1S,3R)-1,3-dimethyl-1,3,4,9-tetrahydro-2H-.beta.-carbolin-2-ol cis-1,3-dimethyl-2-hydroxy-1,2,3,4-tetrahydro-.beta.-carboline
CAS Registry Number 129169-01-3
Comments Less than 3 mono-isotopic peaks
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C13H16N2O
InChI InChI=1S/C13H16N2O/c1-8-7-11-10-5-3-4-6-12(10)14-13(11)9(2)15(8)16/h3-6,8-9,14,16H,7H2,1-2H3/t8-,9+/m1/s1
InChIKey ZBKKVADAUYULII-BDAKNGLRSA-N
Molecular Weight 216.284 g/mol
SMILES [nH]1c2ccccc2c2c1[C@@](N([C@@](C2)(C)[H])O)(C)[H]
SPLASH splash10-0a4i-0920000000-f407131da6d3b35dcbbb
Source of Spectrum F-46-843-6
Wiley ID 1215759