| SpectraBase Spectrum ID |
DDcvRD92JL5 |
| Name |
Acetamide, N-methyl-N-[4-[3-(hydroxymethyl)pyrrolidinyl]-2-butynyl]- |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
224.152477890 u |
| Formula |
C12H20N2O2 |
| InChI |
InChI=1S/C12H20N2O2/c1-11(15)13(2)7-4-5-8-14-9-6-12(10-14)16-3/h12H,6-10H2,1-3H3 |
| InChIKey |
JSHPHSUNFWWJQP-UHFFFAOYSA-N |
| Molecular Weight |
224.304 g/mol |
| SMILES |
C1CN(CC#CCN(C(C)=O)C)CC1OC |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.987443 |
![Acetamide, N-methyl-N-[4-[3-(hydroxymethyl)pyrrolidinyl]-2-butynyl]-](/api/spectrum/DDcvRD92JL5/structure.png?h=300&w=458 "Acetamide, N-methyl-N-[4-[3-(hydroxymethyl)pyrrolidinyl]-2-butynyl]-")
