SpectraBase Spectrum ID |
74mmjj6i2Wk |
Name |
(3R,4S)-5-Morpholino-3,4-dihydroxy-1-pentene |
Comments |
Computed using SmartSpectra Model v1.42 |
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] |
Spectrum/Structure Validation Score (Vapor Phase IR) |
0.94549 |