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4H-Inden-4-one, octahydro-7a-methyl-1-(phenylmethylene)-, cis-
SpectraBase Compound ID 8u3f6Q2w5I0
InChI InChI=1S/C17H20O/c1-17-11-5-8-16(18)15(17)10-9-14(17)12-13-6-3-2-4-7-13/h2-4,6-7,12,15H,5,8-11H2,1H3/b14-12+/t15-,17-/m0/s1
InChIKey XIZVZJMPINFWKM-YTLDMCMYSA-N
Mol Weight 240.35 g/mol
Molecular Formula C17H20O
Exact Mass 240.151415 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID Gawqx1QFpBD
Name 4H-Inden-4-one, octahydro-7a-methyl-1-(phenylmethylene)-, cis-
CAS Registry Number 126790-39-4
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C17H20O
InChI InChI=1S/C17H20O/c1-17-11-5-8-16(18)15(17)10-9-14(17)12-13-6-3-2-4-7-13/h2-4,6-7,12,15H,5,8-11H2,1H3/b14-12+/t15-,17-/m0/s1
InChIKey XIZVZJMPINFWKM-YTLDMCMYSA-N
Molecular Weight 240.346 g/mol
SMILES [C@@]12(\C(=C\c3ccccc3)CC[C@]1(C(=O)CCC2)[H])C
SPLASH splash10-0006-4690000000-86183998e3b5432b9e2b
Source of Spectrum J-57-1442-57
Synonyms (1E,3aR,7aR)-1-benzylidene-7a-methyloctahydro-4H-inden-4-one 1-Benzylidene-8.beta.-methyl-9.beta.-hydrindan-4-one cis-octahydro-7a-methyl-1-(phenylmethylene)-4H-inden-4-one
Wiley ID 1243663