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(1S,4R,9S)-1,7,7-Trimethyl-4-morpholin-4-ylmethyl-6-oxa-tricyclo[6.2.2.0*4,9*]dodecan-3-one
SpectraBase Compound ID 4b5Bh29a9p1
InChI InChI=1S/C19H31NO3/c1-17(2)14-4-5-18(3)10-15(14)19(13-23-17,16(21)11-18)12-20-6-8-22-9-7-20/h14-15H,4-13H2,1-3H3/t14?,15-,18-,19+/m0/s1
InChIKey WLHHJAXKMLBHTG-RQWRQBNFSA-N
Mol Weight 321.46 g/mol
Molecular Formula C19H31NO3
Exact Mass 321.230394 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID EMrWtqb6ssc
Name (1S,4R,9S)-1,7,7-Trimethyl-4-morpholin-4-ylmethyl-6-oxa-tricyclo[6.2.2.0*4,9*]dodecan-3-one
Alternate Name(s) (1S,4R,8S,9S)-1,7,7-trimethyl-4-(4-morpholinylmethyl)-6-oxatricyclo[6.2.2.0(4,9)]dodecan-3-one [4-Methyl(N-morpholino)]-1,7,7-trimethyl-6-oxatricyclo[6.2.2.0.(4,9)]dodecan-3-one
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C19H31NO3
InChI InChI=1S/C19H31NO3/c1-17(2)14-4-5-18(3)10-15(14)19(13-23-17,16(21)11-18)12-20-6-8-22-9-7-20/h14-15H,4-13H2,1-3H3/t14?,15-,18-,19+/m0/s1
InChIKey WLHHJAXKMLBHTG-RQWRQBNFSA-N
Molecular Weight 321.461 g/mol
SMILES [C@@]12([C@@]3(C(CC[C@@](CC2=O)(C)C3)C(OC1)(C)C)[H])CN1CCOCC1
SPLASH splash10-0udi-0900000000-5fa02f4a1b27a8bb2c1c
Source of Spectrum F4-0-3029-27
Wiley ID 1620627