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2,2-Dimethyl-N-[(7Z,9Z)-9-methyl-5,6-dihydrobenzocycloocten-5-yl]propionamide
SpectraBase Compound ID BHc2UG0qwpy
InChI InChI=1S/C19H25NO/c1-13-10-14(2)12-17(20-18(21)19(3,4)5)16-9-7-6-8-15(16)11-13/h6-11,17H,12H2,1-5H3,(H,20,21)/b13-11-,14-10-
InChIKey RSWNTTMSXKZBDU-QFCYPFEVSA-N
Mol Weight 283.41 g/mol
Molecular Formula C19H25NO
Exact Mass 283.193614 g/mol

Vapor Phase (Gas) Infrared Spectrum

Vapor Phase (Gas) Infrared Spectrum

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SpectraBase Spectrum ID 3uS2t7ue6VT
Name 2,2-Dimethyl-N-[(7Z,9Z)-9-methyl-5,6-dihydrobenzocycloocten-5-yl]propionamide
Comments Computed using SmartSpectra Model v1.42
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 283.193614428 u
Formula C19H25NO
InChI InChI=1S/C19H25NO/c1-13-10-14(2)12-17(20-18(21)19(3,4)5)16-9-7-6-8-15(16)11-13/h6-11,17H,12H2,1-5H3,(H,20,21)/b13-11-,14-10-
InChIKey RSWNTTMSXKZBDU-QFCYPFEVSA-N
Molecular Weight 283.415 g/mol
SMILES C1(NC(C(C)(C)C)=O)C=2C(\C=C/(\C=C/(C1)C)C)=CC=CC2
Spectrum/Structure Validation Score (Vapor Phase IR) 0.830592