![1-[3-(Dimethylamino)phenyl]-1-propanol](/api/spectrum/Kio7QQryKBs/structure.png?h=300&w=458 "1-[3-(Dimethylamino)phenyl]-1-propanol")
| SpectraBase Compound ID | 1PxhOWSHOrp |
|---|---|
| InChI | InChI=1S/C11H17NO/c1-4-11(13)9-6-5-7-10(8-9)12(2)3/h5-8,11,13H,4H2,1-3H3 |
| InChIKey | BNQQQWOAPGBUEX-UHFFFAOYSA-N |
| Mol Weight | 179.26 g/mol |
| Molecular Formula | C11H17NO |
| Exact Mass | 179.131014 g/mol |
Vapor Phase (Gas) Infrared Spectrum
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| SpectraBase Spectrum ID | Kio7QQryKBs |
|---|---|
| Name | 1-[3-(Dimethylamino)phenyl]-1-propanol |
| 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/c1-4-11(13)9-6-5-7-10(8-9)12(2)3/h5-8,11,13H,4H2,1-3H3 |
| InChIKey | BNQQQWOAPGBUEX-UHFFFAOYSA-N |
| Molecular Weight | 179.263 g/mol |
| SMILES | C(CC)(O)C=1C=C(C=CC1)N(C)C |
| Spectrum/Structure Validation Score (Vapor Phase IR) | 0.903065 |