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1H-Cyclopenta[a]phenanthren-17-ol, 2,3,4,11,12,13,14,15,16,17-decahydro-3-methoxy-13-methyl-, acetate
SpectraBase Compound ID fefmPNJzVZ
InChI InChI=1S/C21H28O3/c1-13(22)24-20-9-8-19-18-6-4-14-12-15(23-3)5-7-16(14)17(18)10-11-21(19,20)2/h4,6,15,19-20H,5,7-12H2,1-3H3
InChIKey LTKHKJGUZGBAPQ-UHFFFAOYSA-N
Mol Weight 328.45 g/mol
Molecular Formula C21H28O3
Exact Mass 328.203845 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 2Eo18HKsLjr
Name 1H-Cyclopenta[A]phenanthren-17-ol, 2,3,4,11,12,13,14,15,16,17-decahydro-3-methoxy-13-methyl-, acetate
Comments Computed using HOSE algorithm
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 328.203844759 u
Formula C21H28O3
InChI InChI=1S/C21H28O3/c1-13(22)24-20-9-8-19-18-6-4-14-12-15(23-3)5-7-16(14)17(18)10-11-21(19,20)2/h4,6,15,19-20H,5,7-12H2,1-3H3
InChIKey LTKHKJGUZGBAPQ-UHFFFAOYSA-N
Molecular Weight 328.452 g/mol
SMILES CC12C(C3=C(CC2)C2=C(C=C3)CC(CC2)OC)CCC1OC(C)=O