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Bicyclo[2.2.1]heptane-2-carboxylic acid isobutyl-amide

View entire compound with spectra: 1 FTIR

Bicyclo[2.2.1]heptane-2-carboxylic acid isobutyl-amide
SpectraBase Compound ID 3mU60EI7f8k
InChI InChI=1S/C12H21NO/c1-8(2)7-13-12(14)11-6-9-3-4-10(11)5-9/h8-11H,3-7H2,1-2H3,(H,13,14)/t9-,10+,11-/m1/s1
InChIKey HKOPGLPHIFMKDB-OUAUKWLOSA-N
Mol Weight 195.31 g/mol
Molecular Formula C12H21NO
Exact Mass 195.162314 g/mol

Vapor Phase (Gas) Infrared Spectrum

Vapor Phase (Gas) Infrared Spectrum

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SpectraBase Spectrum ID C1PM4eTDXnf
Name Bicyclo[2.2.1]heptane-2-carboxylic acid isobutyl-amide
Comments Computed using SmartSpectra Model v1.42
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 195.162314299 u
Formula C12H21NO
InChI InChI=1S/C12H21NO/c1-8(2)7-13-12(14)11-6-9-3-4-10(11)5-9/h8-11H,3-7H2,1-2H3,(H,13,14)/t9-,10+,11-/m1/s1
InChIKey HKOPGLPHIFMKDB-OUAUKWLOSA-N
Molecular Weight 195.306 g/mol
SMILES C1C[C@@]2([C@](C(NCC(C)C)=O)(C[C@]1(C2)[H])[H])[H]
Spectrum/Structure Validation Score (Vapor Phase IR) 0.899801