| SpectraBase Compound ID | KcpaDtx97qY |
|---|---|
| InChI | InChI=1S/C9H17NO3/c1-2-8(11)9(12)7-10-3-5-13-6-4-10/h2,8-9,11-12H,1,3-7H2/t8-,9+/m1/s1 |
| InChIKey | ZJVLCKAYIASHTQ-BDAKNGLRSA-N |
| Mol Weight | 187.24 g/mol |
| Molecular Formula | C9H17NO3 |
| Exact Mass | 187.120843 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | Cg0LVQ6jq8j |
|---|---|
| Name | (3R,4S)-5-Morpholino-3,4-dihydroxy-1-pentene |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 187.120843408 u |
| Formula | C9H17NO3 |
| InChI | InChI=1S/C9H17NO3/c1-2-8(11)9(12)7-10-3-5-13-6-4-10/h2,8-9,11-12H,1,3-7H2/t8-,9+/m1/s1 |
| InChIKey | ZJVLCKAYIASHTQ-BDAKNGLRSA-N |
| Molecular Weight | 187.239 g/mol |
| SMILES | C(N1CCOCC1)[C@@]([C@@](C=C)(O)[H])(O)[H] |