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13.alpha.-Hydroxy-podocarpan-14-one

View entire compound with spectra: 1 FTIR, and 1 MS (GC)

13.alpha.-Hydroxy-podocarpan-14-one
SpectraBase Compound ID FcQockTeJt8
InChI InChI=1S/C17H28O2/c1-16(2)9-4-10-17(3)12-6-7-13(18)15(19)11(12)5-8-14(16)17/h11-14,18H,4-10H2,1-3H3/t11-,12+,13+,14?,17-/m1/s1
InChIKey BGQAXEOUALVCAX-WMDZGTCOSA-N
Mol Weight 264.41 g/mol
Molecular Formula C17H28O2
Exact Mass 264.20893 g/mol

Vapor Phase (Gas) Infrared Spectrum

Vapor Phase (Gas) Infrared Spectrum

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SpectraBase Spectrum ID DDlZ74ocdHp
Name 13.alpha.-Hydroxy-podocarpan-14-one
Comments Computed using SmartSpectra Model v1.42
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 264.208930140 u
Formula C17H28O2
InChI InChI=1S/C17H28O2/c1-16(2)9-4-10-17(3)12-6-7-13(18)15(19)11(12)5-8-14(16)17/h11-14,18H,4-10H2,1-3H3/t11-,12+,13+,14?,17-/m1/s1
InChIKey BGQAXEOUALVCAX-WMDZGTCOSA-N
Molecular Weight 264.409 g/mol
SMILES [C@]12([C@@]3([C@@](C(=O)[C@](CC3)(O)[H])([H])CCC1C(C)(C)CCC2)[H])C
Spectrum/Structure Validation Score (Vapor Phase IR) 0.907605