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Cyclohepta[b]pyran-5,8-imin-4(4aH)-one, 5,6,7,8,9,9a-hexahydro-2,3,10-trimethyl-
SpectraBase Compound ID KgqwFFmXm4z
InChI InChI=1S/C13H19NO2/c1-7-8(2)16-11-6-9-4-5-10(14(9)3)12(11)13(7)15/h9-12H,4-6H2,1-3H3/t9-,10+,11?,12?/m0/s1
InChIKey JPMXYHUJYSZSPM-DMOGRIERSA-N
Mol Weight 221.3 g/mol
Molecular Formula C13H19NO2
Exact Mass 221.141579 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 4OiK24LqvA
Name Cyclohepta[b]pyran-5,8-imin-4(4aH)-one, 5,6,7,8,9,9a-hexahydro-2,3,10-trimethyl-
Alternate Name(s) (1R,9S)-4,5,12-trimethyl-6-oxa-12-azatricyclo[7.2.1.0(2,7)]dodec-4-en-3-one 5,11-Dihydrodarlingine
CAS Registry Number 73045-44-0
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C13H19NO2
InChI InChI=1S/C13H19NO2/c1-7-8(2)16-11-6-9-4-5-10(14(9)3)12(11)13(7)15/h9-12H,4-6H2,1-3H3/t9-,10+,11?,12?/m0/s1
InChIKey JPMXYHUJYSZSPM-DMOGRIERSA-N
Molecular Weight 221.300 g/mol
SMILES C12C(C(C)=C(OC2C[C@]2(N([C@@]1(CC2)[H])C)[H])C)=O
SPLASH splash10-001l-9100000000-4709f51a9700457b95c9
Source of Spectrum B-32-2531-0
Wiley ID 1221386