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3-HYDROXY-4,4-DIMETHYL-7-OXOANDROST-5-EN-17-YL ACETATE
SpectraBase Compound ID jGumam6Gvv
InChI InChI=1S/C23H34O4/c1-13(24)27-19-7-6-14-20-15(8-10-23(14,19)5)22(4)11-9-18(26)21(2,3)17(22)12-16(20)25/h12,14-15,18-20,26H,6-11H2,1-5H3/t14?,15?,18?,19?,20?,22-,23+/m1/s1
InChIKey KYWBHBZKZGEQMX-YGEOEBKOSA-N
Mol Weight 374.5 g/mol
Molecular Formula C23H34O4
Exact Mass 374.24571 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID GQfqKjlbww9
Name 3-HYDROXY-4,4-DIMETHYL-7-OXOANDROST-5-EN-17-YL ACETATE
Copyright Copyright © 2011-2024 Wiley-VCH GmbH. All Rights Reserved.
Exact Mass 374.245709571 u
Formula C23H34O4
InChI InChI=1S/C23H34O4/c1-13(24)27-19-7-6-14-20-15(8-10-23(14,19)5)22(4)11-9-18(26)21(2,3)17(22)12-16(20)25/h12,14-15,18-20,26H,6-11H2,1-5H3/t14?,15?,18?,19?,20?,22-,23+/m1/s1
InChIKey KYWBHBZKZGEQMX-YGEOEBKOSA-N
Molecular Weight 374.521 g/mol
Nominal Mass 374 u
Number of Peaks 331
SMILES OC1CC[C@@]2(C3CC[C@@]4(C(CCC4C3C(C=C2C1(C)C)=O)OC(C)=O)C)C
SPLASH splash10-0006-6933000000-cd97249f982a93ff2fa3
Source File Reference LMCM-57090-785S
Source of Spectrum Prof. J. Seibl; ETH Zurich, Switzerland
Synonyms (2R,15S)-5-hydroxy-2,6,6,15-tetramethyl-9-oxotetracyclo[8.7.0.0(2,7).0(11,15)]heptadec-7-en-14-yl acetate ACETIC ACID 3-HYDROXY-4,4,10,13-TETRAMETHYL-7-OXO-2,3,4,7,8,9,10,11,12,13,14,15,16,17-TETRADECAHYDRO-1H-CYCLOPENTA[A]PHENANTHREN-17-YL ESTER
Wiley ID 8_13929