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(10Ar)-6-oxodecahydro-7,10-methanopyrido[1,2-A]azepin-9-yl cyclohexylcarbamate
SpectraBase Compound ID 6j9VUdTrgF6
InChI InChI=1S/C18H28N2O3/c21-17-12-10-14(15-8-4-5-9-20(15)17)16(11-12)23-18(22)19-13-6-2-1-3-7-13/h12-16H,1-11H2,(H,19,22)/t12?,14?,15-,16?/m1/s1
InChIKey HXCMJZWVBAGEFX-DJHYXBCOSA-N
Mol Weight 320.43 g/mol
Molecular Formula C18H28N2O3
Exact Mass 320.209993 g/mol

Vapor Phase (Gas) Infrared Spectrum

Vapor Phase (Gas) Infrared Spectrum

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SpectraBase Spectrum ID EyCHsDMM28N
Name (10Ar)-6-oxodecahydro-7,10-methanopyrido[1,2-A]azepin-9-yl cyclohexylcarbamate
Comments Computed using SmartSpectra Model v1.42
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 320.209992767 u
Formula C18H28N2O3
InChI InChI=1S/C18H28N2O3/c21-17-12-10-14(15-8-4-5-9-20(15)17)16(11-12)23-18(22)19-13-6-2-1-3-7-13/h12-16H,1-11H2,(H,19,22)/t12?,14?,15-,16?/m1/s1
InChIKey HXCMJZWVBAGEFX-DJHYXBCOSA-N
Molecular Weight 320.433 g/mol
SMILES C(NC1CCCCC1)(=O)OC1CC2C(N3[C@@](C1C2)(CCCC3)[H])=O
Spectrum/Structure Validation Score (Vapor Phase IR) 0.926287