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[1S,3aS,4S,7aS]-(+)-1-tert-Butoxy-4-isopropyl-7a-methyl-3a,4,7,7a-tetrahydro-5(6)-indan-5-one
SpectraBase Compound ID 8ldCjYt5XVY
InChI InChI=1S/C17H30O2/c1-11(2)15-12-7-8-14(19-16(3,4)5)17(12,6)10-9-13(15)18/h11-12,14-15H,7-10H2,1-6H3/t12-,14-,15-,17-/m0/s1
InChIKey XEBPQJARZNIOPW-QEWYBTABSA-N
Mol Weight 266.42 g/mol
Molecular Formula C17H30O2
Exact Mass 266.22458 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 6slogA4KgS0
Name [1S,3aS,4S,7aS]-(+)-1-tert-Butoxy-4-isopropyl-7a-methyl-3a,4,7,7a-tetrahydro-5(6)-indan-5-one
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C17H30O2
InChI InChI=1S/C17H30O2/c1-11(2)15-12-7-8-14(19-16(3,4)5)17(12,6)10-9-13(15)18/h11-12,14-15H,7-10H2,1-6H3/t12-,14-,15-,17-/m0/s1
InChIKey XEBPQJARZNIOPW-QEWYBTABSA-N
Molecular Weight 266.425 g/mol
SMILES [C@@]12([C@]([C@](C(C)C)(C(CC2)=O)[H])(CC[C@@]1(OC(C)(C)C)[H])[H])C
SPLASH splash10-0a4i-9480000000-805994b545a10acbe25b
Source of Spectrum F-47-7590-10
Synonyms (1S,3aS,4S,7aS)-1-tert-butoxy-4-isopropyl-7a-methyloctahydro-5H-inden-5-one
Wiley ID 1270580