SpectraBase Compound ID | DOBzV4nvMrW |
---|---|
InChI | InChI=1S/C15H26O3/c1-13(2)6-5-7-14(3)9(8-16)15(4)12(18-15)10(17)11(13)14/h9-12,16-17H,5-8H2,1-4H3/t9-,10+,11?,12+,14-,15-/m1/s1 |
InChIKey | CQPOKEOPVJGEOP-UBSNVAGSSA-N |
Mol Weight | 254.37 g/mol |
Molecular Formula | C15H26O3 |
Exact Mass | 254.188195 g/mol |
SpectraBase Spectrum ID | Hg76IgqoDVV |
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Name | Uvidin C |
Comments | Computed using SmartSpectra Model v1.42 |
Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass | 254.188194694 u |
Formula | C15H26O3 |
InChI | InChI=1S/C15H26O3/c1-13(2)6-5-7-14(3)9(8-16)15(4)12(18-15)10(17)11(13)14/h9-12,16-17H,5-8H2,1-4H3/t9-,10+,11?,12+,14-,15-/m1/s1 |
InChIKey | CQPOKEOPVJGEOP-UBSNVAGSSA-N |
Molecular Weight | 254.370 g/mol |
SMILES | C1CC(C2[C@](C1)([C@@](CO)([C@@]1([C@]([C@]2(O)[H])(O1)[H])C)[H])C)(C)C |
Spectrum/Structure Validation Score (Vapor Phase IR) | 0.969434 |