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TRANS-CIS-NEPETALACTONE
SpectraBase Compound ID 9cox3eWnSR2
InChI InChI=1S/C10H14O2/c1-6-3-4-8-7(2)5-12-10(11)9(6)8/h5-6,8-9H,3-4H2,1-2H3/t6-,8+,9-/m1/s1
InChIKey ZDKZHVNKFOXMND-BWVDBABLSA-N
Mol Weight 166.22 g/mol
Molecular Formula C10H14O2
Exact Mass 166.09938 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID DThDBzKPcWo
Name 4a.alpha.,7.alpha.,7a.beta.-nepetalactone
Alternate Name(s) epinepetalactone Nepetalactone trans-cis-form
CAS Registry Number 17257-15-7
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C10H14O2
InChI InChI=1S/C10H14O2/c1-6-3-4-8-7(2)5-12-10(11)9(6)8/h5-6,8-9H,3-4H2,1-2H3/t6-,8+,9-/m1/s1
InChIKey ZDKZHVNKFOXMND-BWVDBABLSA-N
Molecular Weight 166.220 g/mol
SMILES C1([C@]2([C@](CC[C@]2(C)[H])([H])C(=CO1)C)[H])=O
SPLASH splash10-0159-9600000000-5baa1bb168015e6c1aad
Source of Spectrum J-45-3813-0
Wiley ID 1162561