For citations & permissions, please see: Citations & Permissions - Wiley Science Solutions*

*Links on SpectraBase are not permalinks.

(+/-)-1,2,3,4,4a,9,10,10a alpha-octahydro-2-oxo-4a beta-phenanthrenecarboxylic acid, methyl ester

View entire compound with spectra: 1 NMR, and 1 FTIR

(+/-)-1,2,3,4,4a,9,10,10a alpha-octahydro-2-oxo-4a beta-phenanthrenecarboxylic acid, methyl ester
SpectraBase Compound ID I46gA53UHKK
InChI InChI=1S/C16H18O3/c1-19-15(18)16-9-8-13(17)10-12(16)7-6-11-4-2-3-5-14(11)16/h2-5,12H,6-10H2,1H3/t12-,16+/m0/s1 InChI=1S/C16H18O3/c1-19-15(18)16-9-8-13(17)10-12(16)7-6-11-4-2-3-5-14(11)16/h2-5,12H,6-10H2,1H3/t12-,16+/m1/s1
InChIKey DBJRKQGBGGACBI-BLLLJJGKSA-N
Mol Weight 258.32 g/mol
Molecular Formula C16H18O3
Exact Mass 258.125594 g/mol

Transmission Infrared (IR) Spectrum

Transmission Infrared (IR) Spectrum

View the Full Spectrum for FREE!

The full spectrum can only be viewed using a FREE account.

SpectraBase Spectrum ID 8ixaLip0XPp
Name (+/-)-1,2,3,4,4a,9,10,10aalpha-OCTAHYDRO-2-OXO-4abeta-PHENANTHRENECARBOXYLIC ACID, METHYL ESTER
Source of Sample G. Sinha and U. R. Ghatak, Indian Association For the Cultivation of Science, Calcutta, India
Copyright Copyright © 1980, 1981-2025 John Wiley & Sons, Inc. All Rights Reserved.
Formula C16H18O3
InChI InChI=1S/C16H18O3/c1-19-15(18)16-9-8-13(17)10-12(16)7-6-11-4-2-3-5-14(11)16/h2-5,12H,6-10H2,1H3/t12-,16+/m0/s1 InChI=1S/C16H18O3/c1-19-15(18)16-9-8-13(17)10-12(16)7-6-11-4-2-3-5-14(11)16/h2-5,12H,6-10H2,1H3/t12-,16+/m1/s1
InChIKey DBJRKQGBGGACBI-BLLLJJGKSA-N
Literature Reference INDIAN J. CHEM. B 20, 411(1981) Abstract-Chemical Abstracts= 95, 169516(1981)
Melting Point 118C
Molecular Weight 258.316986
Synonyms 4AB-PHENANTHRENECARBOXYLIC ACID, 1,2,3,4,4A,9,10,10AA-OCTAHYDRO-2-OXO-, METHYL ESTER, /PLUS,MINUS/-,
Technique KBr WAFER