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4a.alpha.,7.alpha.,7a.beta.-Nepetalactone
SpectraBase Compound ID HY39C23tMF9
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
InChIKey ZDKZHVNKFOXMND-UHFFFAOYSA-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 8GFVGwYtXSC
Name Nepetalactone
CAS Registry Number 21651-53-6
Classification Pheromone
Copyright Copyright © 2024-2025 DigiLab GmbH and Wiley-VCH GmbH. All Rights Reserved.
Exact Mass 166.099379689 u
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
InChIKey ZDKZHVNKFOXMND-UHFFFAOYSA-N
Ionization Type Electron Ionization (EI)
Molecular Weight 166.220 g/mol
Nominal Mass 166 u
Quality 906
Retention Index 1236
SMILES C12C(C(=COC2=O)C)CCC1C
SPLASH splash10-0159-9300000000-19ac0b5732cf1f225fc7
Source of Spectrum DigiLab GmbH (C) 2024
Synonyms (4aR,7S,7aS)-4,7-Dimethyl-5,6,7,7a-tetrahydrocyclopenta[c]pyran-1(4ah)-one
Technique GC/MS
Wiley ID DD2024_026406