SpectraBase Compound ID | PhAlD6w19h |
---|---|
InChI | InChI=1S/C11H17NO/c1-11(2,12)8-9-4-6-10(13-3)7-5-9/h4-7H,8,12H2,1-3H3 |
InChIKey | DUMKDWRRTLFHTA-UHFFFAOYSA-N |
Mol Weight | 179.26 g/mol |
Molecular Formula | C11H17NO |
Exact Mass | 179.131014 g/mol |
SpectraBase Spectrum ID | AtXhuqgYmUT |
---|---|
Name | 1-(4-Methoxyphenyl)-2-methylpropan-2-amine |
Comments | Computed using SmartSpectra Model v1.42 |
Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass | 179.131014170 u |
Formula | C11H17NO |
InChI | InChI=1S/C11H17NO/c1-11(2,12)8-9-4-6-10(13-3)7-5-9/h4-7H,8,12H2,1-3H3 |
InChIKey | DUMKDWRRTLFHTA-UHFFFAOYSA-N |
Molecular Weight | 179.263 g/mol |
SMILES | C(N)(CC1=CC=C(C=C1)OC)(C)C |
Spectrum/Structure Validation Score (Vapor Phase IR) | 0.920773 |