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1-(1,5-dimethylhexyl)-9a,11a-dimethyl-2,3,3a,3b,4,5,5a,8,9,9b,10,11-dodecahydro-1H-indeno[5,4-f]chromen-7-one
SpectraBase Compound ID LRnlgL0ZTow
InChI InChI=1S/C26H44O2/c1-17(2)7-6-8-18(3)20-10-11-21-19-9-12-23-26(5,16-14-24(27)28-23)22(19)13-15-25(20,21)4/h17-23H,6-16H2,1-5H3
InChIKey MQKKKKQKYWNSRB-UHFFFAOYSA-N
Mol Weight 388.6 g/mol
Molecular Formula C26H44O2
Exact Mass 388.334131 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 5kNsvirpKcH
Name 1-(1,5-dimethylhexyl)-9a,11a-dimethyl-2,3,3a,3b,4,5,5a,8,9,9b,10,11-dodecahydro-1H-indeno[5,4-f]chromen-7-one
CAS Registry Number 2061-74-7
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C26H44O2
InChI InChI=1S/C26H44O2/c1-17(2)7-6-8-18(3)20-10-11-21-19-9-12-23-26(5,16-14-24(27)28-23)22(19)13-15-25(20,21)4/h17-23H,6-16H2,1-5H3
InChIKey MQKKKKQKYWNSRB-UHFFFAOYSA-N
Molecular Weight 388.636 g/mol
SMILES CC12C(C3C(C4(C)C(OC(=O)CC4)CC3)CC1)CCC2C(CCCC(C)C)C
SPLASH splash10-001u-9044000000-e7a14d65ba2febfbea93
Source of Spectrum AJ-60-2458-2
Synonyms 9a,11a-dimethyl-1-(6-methylheptan-2-yl)-2,3,3a,3b,4,5,5a,8,9,9b,10,11-dodecahydro-1H-indeno[5,4-f]chromen-7-one 9a,11a-dimethyl-1-(6-methylheptan-2-yl)-2,3,3a,3b,4,5,5a,8,9,9b,10,11-dodecahydro-1H-indeno[5,4-f][1]benzopyran-7-one
Wiley ID 1364163