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3,4alpha-Dihydro-4aalpha,7alpha,7aalpha-nepetalactone
SpectraBase Compound ID JOAhSVMSWtX
InChI InChI=1S/C10H16O2/c1-6-3-4-8-7(2)5-12-10(11)9(6)8/h6-9H,3-5H2,1-2H3/t6-,7+,8+,9+/m0/s1
InChIKey LSRNBGXEEKNZHN-JQCXWYLXSA-N
Mol Weight 168.24 g/mol
Molecular Formula C10H16O2
Exact Mass 168.11503 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 6gglLBq4jkN
Name 4,7-Dimethylhexahydrocyclopenta[c]pyran-1(3H)-one
CAS Registry Number 21950-33-4
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C10H16O2
InChI InChI=1S/C10H16O2/c1-6-3-4-8-7(2)5-12-10(11)9(6)8/h6-9H,3-5H2,1-2H3/t6-,7+,8+,9+/m0/s1
InChIKey LSRNBGXEEKNZHN-JQCXWYLXSA-N
Molecular Weight 168.236 g/mol
SMILES C1([C@]2([C@](CC[C@@]2(C)[H])([C@](C)(CO1)[H])[H])[H])=O
SPLASH splash10-02ai-9700000000-06c2cd4d43d9df92d97c
Source of Spectrum LQ-1992-3907-0
Synonyms .alpha.-Dihydronepetalactone 4,7-Dimethyl-4,4a,5,6,7,7a-hexahydro-3H-cyclopenta[c]pyran-1-one Cyclopenta[c]pyran-1(3H)-one, hexahydro-4,7-dimethyl- Cyclopenta[c]pyran-1(3H)-one, hexahydro-4,7-dimethyl-, (4.alpha.,4a.alpha.,7.alpha.,7a.alpha.)- Cyclopenta[c]pyran-1(3H)-one, hexahydro-4.alpha.,7.alpha.-dimethyl- Isodihydronepetalactone Nepetalactone, .alpha.-dihydro- Nepetalactone, isodihydro-
Wiley ID 1164677