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N-Methylpiperidino[2,4-B,C]1,2,3,4-tetrahydro-3,4-dipropyl-6-methoxynaphthalene

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N-Methylpiperidino[2,4-B,C]1,2,3,4-tetrahydro-3,4-dipropyl-6-methoxynaphthalene
SpectraBase Compound ID EOxkhR7vf2p
InChI InChI=1S/C20H31NO/c1-5-7-17-19-13-15-8-9-16(22-4)14-18(15)20(17,10-6-2)11-12-21(19)3/h8-9,14,17,19H,5-7,10-13H2,1-4H3/t17-,19-,20-/m0/s1
InChIKey OABHMBFSYXQVKK-IHPCNDPISA-N
Mol Weight 301.47 g/mol
Molecular Formula C20H31NO
Exact Mass 301.240565 g/mol

Vapor Phase (Gas) Infrared Spectrum

Vapor Phase (Gas) Infrared Spectrum

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SpectraBase Spectrum ID KJ0nUJsYn3U
Name N-Methylpiperidino[2,4-B,C]1,2,3,4-tetrahydro-3,4-dipropyl-6-methoxynaphthalene
Comments Computed using SmartSpectra Model v1.42
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 301.240564621 u
Formula C20H31NO
InChI InChI=1S/C20H31NO/c1-5-7-17-19-13-15-8-9-16(22-4)14-18(15)20(17,10-6-2)11-12-21(19)3/h8-9,14,17,19H,5-7,10-13H2,1-4H3/t17-,19-,20-/m0/s1
InChIKey OABHMBFSYXQVKK-IHPCNDPISA-N
SMILES C1=CC2=C(C=C1OC)[C@@]1([C@]([C@](C2)(N(CC1)C)[H])(CCC)[H])CCC
Spectrum/Structure Validation Score (Vapor Phase IR) 0.832077