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(3S)-6-(Benzylamino)-3-hydroxy-hexacyclo[6.5.0.0.3,7).0(4,12).0(5,10).0(9,13)]tridecane

View entire compound with spectra: 1 FTIR, and 1 MS (GC)

(3S)-6-(Benzylamino)-3-hydroxy-hexacyclo[6.5.0.0.3,7).0(4,12).0(5,10).0(9,13)]tridecane
SpectraBase Compound ID oJnAADgtAH
InChI InChI=1S/C20H23NO/c22-20-7-12-13-11-6-10-14(13)15(12)18(20)19(16(10)17(11)20)21-8-9-4-2-1-3-5-9/h1-5,10-19,21-22H,6-8H2/t10?,11?,12?,13?,14?,15?,16?,17?,18?,19?,20-/m1/s1
InChIKey AHNAXRVAXYZGBG-PJBWRRPBSA-N
Mol Weight 293.41 g/mol
Molecular Formula C20H23NO
Exact Mass 293.177964 g/mol

Vapor Phase (Gas) Infrared Spectrum

Vapor Phase (Gas) Infrared Spectrum

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SpectraBase Spectrum ID CmYAewht6Az
Name (3S)-6-(Benzylamino)-3-hydroxy-hexacyclo[6.5.0.0.3,7).0(4,12).0(5,10).0(9,13)]tridecane
Comments Computed using SmartSpectra Model v1.42
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 293.177964364 u
Formula C20H23NO
InChI InChI=1S/C20H23NO/c22-20-7-12-13-11-6-10-14(13)15(12)18(20)19(16(10)17(11)20)21-8-9-4-2-1-3-5-9/h1-5,10-19,21-22H,6-8H2/t10?,11?,12?,13?,14?,15?,16?,17?,18?,19?,20-/m1/s1
InChIKey AHNAXRVAXYZGBG-PJBWRRPBSA-N
SMILES [C@]12(C3C4C5C(C4C2)C2C1C(C5C2)C3NCC1=CC=CC=C1)O
Spectrum/Structure Validation Score (Vapor Phase IR) 0.834487