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Cyclotetradeca[b]furan-2(3H)-one, 3-(4,5-dihydro-3H-pyrazol-3-ylidene)-3a,4,7,8,11,12,15,15a-octahydro- 6,10,14-trimethyl-, [3aR-(3aR*,5E,9E,13E,15aS*)]-
SpectraBase Compound ID 8CvElIRjSq
InChI InChI=1S/C22H30N2O2/c1-15-6-4-8-16(2)10-11-18-20(14-17(3)9-5-7-15)26-22(25)21(18)19-12-13-23-24-19/h6,9-10,18,20H,4-5,7-8,11-14H2,1-3H3/b15-6+,16-10+,17-9+,21-19+/t18-,20-/m0/s1
InChIKey CWKYIKKFAUQHKJ-GXIFKBJMSA-N
Mol Weight 354.49 g/mol
Molecular Formula C22H30N2O2
Exact Mass 354.230728 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 6FdUXReIRkD
Name Cyclotetradeca[b]furan-2(3H)-one, 3-(4,5-dihydro-3H-pyrazol-3-ylidene)-3a,4,7,8,11,12,15,15a-octahydro- 6,10,14-trimethyl-, [3aR-(3aR*,5E,9E,13E,15aS*)]-
CAS Registry Number 71876-49-8
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C22H30N2O2
InChI InChI=1S/C22H30N2O2/c1-15-6-4-8-16(2)10-11-18-20(14-17(3)9-5-7-15)26-22(25)21(18)19-12-13-23-24-19/h6,9-10,18,20H,4-5,7-8,11-14H2,1-3H3/b15-6+,16-10+,17-9+,21-19+/t18-,20-/m0/s1
InChIKey CWKYIKKFAUQHKJ-GXIFKBJMSA-N
Molecular Weight 354.494 g/mol
SMILES C1(\C([C@@]2([C@@](O1)(C\C(=C\CC\C(=C\CC\C(=C\C2)C)C)C)[H])[H])=C/1N=NCC1)=O
SPLASH splash10-0a4i-0900000000-3b8ce5ce2006f10add6d
Source of Spectrum B-32-1279-0
Synonyms (3E,3aR,15aS)-3-(4,5-dihydro-3H-pyrazol-3-ylidene)-6,10,14-trimethyl-3a,4,7,8,11,12,15,15a-octahydrocyclotetradeca[b]furan-2(3H)-one (E,E,E)-6,10,14-trimethyl-3(3-pyrazolinyl)trans-3a,4,7,8,11,12,15,15a-octahydrocyclotetradeca(b)furan-2(3H-one
Wiley ID 1344897