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6-ALLYL-3-(CYCLOBUTYLMETHYL)-1,2,3,4,5,6-HEXAHYDRO-8-METHOXY-2,6-METHANO-3-BENZAZOCIN-11-ONE, OXALATE (1:1) (SALT)
SpectraBase Compound ID 5I35m0ISMCi
InChI InChI=1S/C21H27NO2.C2H2O4/c1-3-9-21-10-11-22(14-15-5-4-6-15)19(20(21)23)12-16-7-8-17(24-2)13-18(16)21;3-1(4)2(5)6/h3,7-8,13,15,19H,1,4-6,9-12,14H2,2H3;(H,3,4)(H,5,6)
InChIKey DKAAVTUXFAQROO-UHFFFAOYSA-N
Mol Weight 415.49 g/mol
Molecular Formula C23H29NO6
Exact Mass 415.199488 g/mol

Transmission Infrared (IR) Spectrum

Transmission Infrared (IR) Spectrum

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SpectraBase Spectrum ID 5YlAFpKSrL5
Name 6-ALLYL-3-(CYCLOBUTYLMETHYL)-1,2,3,4,5,6-HEXAHYDRO-8-METHOXY-2,6-METHANO-3-BENZAZOCIN-11-ONE, OXALATE (1:1) (SALT)
Source of Sample G. Kavadias, Bristol Laboratories of Canada, Quebec, Canada
Copyright Copyright © 1980, 1981-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C23H29NO6
InChI InChI=1S/C21H27NO2.C2H2O4/c1-3-9-21-10-11-22(14-15-5-4-6-15)19(20(21)23)12-16-7-8-17(24-2)13-18(16)21;3-1(4)2(5)6/h3,7-8,13,15,19H,1,4-6,9-12,14H2,2H3;(H,3,4)(H,5,6)
InChIKey DKAAVTUXFAQROO-UHFFFAOYSA-N
Literature Reference CAN. J. CHEM. 57, 1866(1979) Abstract-Chemical Abstracts= 91, 175579(1979)
Melting Point 182-182.5C
Molecular Weight 415.485992
Synonyms 2,6-METHANO-3-BENZAZOCIN-11-ONE, 6-ALLYL-3-/CYCLOBUTYLMETHYL/-1,2,3,4,- 5,6-HEXAHYDRO-8-METHOXY-, OXALATE /1 TO 1/ /SALT/
Technique KBr WAFER