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Androst-4-en-17-one, 3,6-dihydroxy-, (3.alpha.,6.beta.)-
SpectraBase Compound ID J8pePKDE498
InChI InChI=1S/C19H28O3/c1-18-7-5-11(20)9-15(18)16(21)10-12-13-3-4-17(22)19(13,2)8-6-14(12)18/h9,11-14,16,20-21H,3-8,10H2,1-2H3/t11-,12+,13+,14+,16-,18-,19+/m1/s1
InChIKey HPSYAPKUNHFUQZ-FWCKWNPBSA-N
Mol Weight 304.43 g/mol
Molecular Formula C19H28O3
Exact Mass 304.203845 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 2Wo01RfUDQ
Name Androst-4-en-17-one, 3,6-dihydroxy-, (3.alpha.,6.beta.)-
Alternate Name(s) (3alpha,6beta)-3,6-dihydroxyandrost-4-en-17-one 3.alpha.,6.beta.-dihydroxyandrost-4-ene-17-one
CAS Registry Number 70005-44-6
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C19H28O3
InChI InChI=1S/C19H28O3/c1-18-7-5-11(20)9-15(18)16(21)10-12-13-3-4-17(22)19(13,2)8-6-14(12)18/h9,11-14,16,20-21H,3-8,10H2,1-2H3/t11-,12+,13+,14+,16-,18-,19+/m1/s1
InChIKey HPSYAPKUNHFUQZ-FWCKWNPBSA-N
Molecular Weight 304.430 g/mol
SMILES O[C@]1(C=2[C@](CC[C@](C2)(O)[H])([C@@]2([C@@](C1)([C@@]1(CCC([C@]1(CC2)C)=O)[H])[H])[H])C)[H]
SPLASH splash10-0079-0090000000-398fc6849c83b10c77d5
Source of Spectrum I-57-439-0
Wiley ID 1306707