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(2S,4aS,8aR)-2,5,5-Trimethyloctahydro-1H-2,4a-methanonaphthalen-1-one
SpectraBase Compound ID 6z9SRTj7FqK
InChI InChI=1S/C14H22O/c1-12(2)6-4-5-10-11(15)13(3)7-8-14(10,12)9-13/h10H,4-9H2,1-3H3/t10-,13-,14-/m0/s1
InChIKey UBSJUMZOLIKMIE-BPNCWPANSA-N
Mol Weight 206.33 g/mol
Molecular Formula C14H22O
Exact Mass 206.167065 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 5P8bwU8IxQw
Name (2S,4aS,8aR)-2,5,5-Trimethyloctahydro-1H-2,4a-methanonaphthalen-1-one
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C14H22O
InChI InChI=1S/C14H22O/c1-12(2)6-4-5-10-11(15)13(3)7-8-14(10,12)9-13/h10H,4-9H2,1-3H3/t10-,13-,14-/m0/s1
InChIKey UBSJUMZOLIKMIE-BPNCWPANSA-N
Literature Reference DOI 10.1021/jo500942a
Molecular Weight 206.329 g/mol
SMILES C1(C)(C)[C@@]23C[C@](CC3)(C(=O)[C@@]2(CCC1)[H])C
SPLASH splash10-0ac0-7930000000-8f49430d8bdbc84b246e
Source of Spectrum J-79-6731-31
Synonyms (+)-Herbanone
Wiley ID 1746315