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2-Methyl-4,5,6,6a-tetrahydro-3aH-cyclopenta[d]oxazole

View entire compound with spectra: 1 FTIR, and 1 MS (GC)

2-Methyl-4,5,6,6a-tetrahydro-3aH-cyclopenta[d]oxazole
SpectraBase Compound ID Itey10Au0wh
InChI InChI=1S/C7H11NO/c1-5-8-6-3-2-4-7(6)9-5/h6-7H,2-4H2,1H3/t6-,7+/m0/s1
InChIKey OSQNAOSXUOTTBO-NKWVEPMBSA-N
Mol Weight 125.17 g/mol
Molecular Formula C7H11NO
Exact Mass 125.084064 g/mol

Vapor Phase (Gas) Infrared Spectrum

Vapor Phase (Gas) Infrared Spectrum

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SpectraBase Spectrum ID BqNUUbU4dsO
Name 2-Methyl-4,5,6,6A-tetrahydro-3ah-cyclopenta[D]oxazole
Comments Computed using SmartSpectra Model v1.42
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 125.084063977 u
Formula C7H11NO
InChI InChI=1S/C7H11NO/c1-5-8-6-3-2-4-7(6)9-5/h6-7H,2-4H2,1H3/t6-,7+/m0/s1
InChIKey OSQNAOSXUOTTBO-NKWVEPMBSA-N
Molecular Weight 125.171 g/mol
SMILES C1(=N[C@@]2([C@](O1)(CCC2)[H])[H])C
Spectrum/Structure Validation Score (Vapor Phase IR) 0.92429