SpectraBase Spectrum ID |
H5VxMJg6JIe |
Name |
2-Hydroxyheptylpiperidine |
Comments |
Computed using SmartSpectra Model v1.42 |
Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass |
199.193614428 u |
Formula |
C12H25NO |
InChI |
InChI=1S/C12H25NO/c1-2-3-4-8-12(14)10-11-7-5-6-9-13-11/h11-14H,2-10H2,1H3/t11-,12-/m0/s1 |
InChIKey |
JBGNJPYDPXFHEX-RYUDHWBXSA-N |
Molecular Weight |
199.338 g/mol |
SMILES |
[C@]1(NCCCC1)(C[C@@](O)(CCCCC)[H])[H] |
Spectrum/Structure Validation Score (Vapor Phase IR) |
0.976477 |