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14-Methoxy-A-nor-erythrinane
SpectraBase Compound ID 59a81FzwXXU
InChI InChI=1S/C16H21NO/c1-18-14-5-4-12-6-9-17-10-7-13-3-2-8-16(13,17)15(12)11-14/h4-5,11,13H,2-3,6-10H2,1H3/t13-,16-/m0/s1
InChIKey LWDKZZDWSHDSKR-BBRMVZONSA-N
Mol Weight 243.35 g/mol
Molecular Formula C16H21NO
Exact Mass 243.162314 g/mol

Vapor Phase (Gas) Infrared Spectrum

Vapor Phase (Gas) Infrared Spectrum

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SpectraBase Spectrum ID 9lWH1QXDkWl
Name 14-Methoxy-A-nor-erythrinane
Comments Computed using SmartSpectra Model v1.42
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 243.162314299 u
Formula C16H21NO
InChI InChI=1S/C16H21NO/c1-18-14-5-4-12-6-9-17-10-7-13-3-2-8-16(13,17)15(12)11-14/h4-5,11,13H,2-3,6-10H2,1H3/t13-,16-/m0/s1
InChIKey LWDKZZDWSHDSKR-BBRMVZONSA-N
Molecular Weight 243.350 g/mol
SMILES [C@]123C=4C(=CC=C(C4)OC)CCN1CC[C@@]2(CCC3)[H]
Spectrum/Structure Validation Score (Vapor Phase IR) 0.815802