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7-Hydroxy-pregna-4-ene-3-one-20-carbaldehyde

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

7-Hydroxy-pregna-4-ene-3-one-20-carbaldehyde
SpectraBase Compound ID JerzyPejoXm
InChI InChI=1S/C22H32O3/c1-13(12-23)16-4-5-17-20-18(7-9-22(16,17)3)21(2)8-6-15(24)10-14(21)11-19(20)25/h10,12-13,16-20,25H,4-9,11H2,1-3H3
InChIKey ALHATGQVHVESGQ-UHFFFAOYSA-N
Mol Weight 344.5 g/mol
Molecular Formula C22H32O3
Exact Mass 344.235145 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID AZj8lDGUIEM
Name 7-Hydroxy-pregna-4-ene-3-one-20-carbaldehyde
Copyright Copyright © 2020-2025 John Wiley & Sons, Inc. All Rights Reserved.
Formula C22H32O3
InChI InChI=1S/C22H32O3/c1-13(12-23)16-4-5-17-20-18(7-9-22(16,17)3)21(2)8-6-15(24)10-14(21)11-19(20)25/h10,12-13,16-20,25H,4-9,11H2,1-3H3
InChIKey ALHATGQVHVESGQ-UHFFFAOYSA-N
Ionization Type EI-B
Molecular Weight 344.495 g/mol
SMILES OC1C2C3C(C(C(C=O)C)CC3)(C)CCC2C2(C)CCC(C=C2C1)=O
SPLASH splash10-00di-3901000000-eeea3e7367efb3a4dcea
Source of Spectrum SRH-2022-10046-0
Wiley ID 1831678