SpectraBase Compound ID | 39SNjD0sOFc |
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InChI | InChI=1S/C10H11NO2/c1-10(8(13-10)9(11)12)7-5-3-2-4-6-7/h2-6,8H,1H3,(H2,11,12) |
InChIKey | GPGCVLMDAHRNJI-UHFFFAOYSA-N |
Mol Weight | 177.2 g/mol |
Molecular Formula | C10H11NO2 |
Exact Mass | 177.078979 g/mol |
SpectraBase Spectrum ID | KEGhsRe54zA |
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Name | Butyramide, 2,3-epoxy-3-phenyl- |
Comments | Computed using SmartSpectra Model v1.42 |
Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass | 177.078978596 u |
Formula | C10H11NO2 |
InChI | InChI=1S/C10H11NO2/c1-10(8(13-10)9(11)12)7-5-3-2-4-6-7/h2-6,8H,1H3,(H2,11,12) |
InChIKey | GPGCVLMDAHRNJI-UHFFFAOYSA-N |
Molecular Weight | 177.203 g/mol |
SMILES | C1(C2=CC=CC=C2)(OC1C(=O)N)C |
Spectrum/Structure Validation Score (Vapor Phase IR) | 0.853626 |