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1,2,3a,4,5,cis-9b-HEXAHYDRO-trans-5-HYDROXY-7-METHOXY-3H-BENZ[e]INDEN-3-ONE, ACETATE
SpectraBase Compound ID JIZSWZ5zur0
InChI InChI=1S/C16H18O4/c1-9(17)20-16-8-13-11(5-6-15(13)18)12-4-3-10(19-2)7-14(12)16/h3-4,7,11,13,16H,5-6,8H2,1-2H3/t11-,13+,16-/s2
InChIKey KVGTVAFFHBFFLR-PXPMBSLVSA-N
Mol Weight 274.32 g/mol
Molecular Formula C16H18O4
Exact Mass 274.120509 g/mol

Transmission Infrared (IR) Spectrum

Transmission Infrared (IR) Spectrum

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SpectraBase Spectrum ID 5vTHXvMLz61
Name 1,2,3a,4,5,cis-9b-HEXAHYDRO-trans-5-HYDROXY-7-METHOXY-3H-BENZ[e]INDEN-3-ONE, ACETATE
Source of Sample G. Grinenko, All Union Chemical-Pharmaceutical Research Institute, Moscow, Russia
Copyright Copyright © 1980, 1981-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C16H18O4
InChI InChI=1S/C16H18O4/c1-9(17)20-16-8-13-11(5-6-15(13)18)12-4-3-10(19-2)7-14(12)16/h3-4,7,11,13,16H,5-6,8H2,1-2H3/t11-,13+,16-/s2
InChIKey KVGTVAFFHBFFLR-PXPMBSLVSA-N
Literature Reference Abstract-Chemical Abstracts= 60, 5423(1964)
Melting Point 80.5-81.5C
Molecular Weight 274.316010
Synonyms 3H-BENZ/E/INDEN-3-ONE, 1,2,3A,4,5,CIS- 9B-HEXAHYDRO-TRANS-5-HYDROXY-7- METHOXY-, ACETATE
Technique KBr WAFER