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(3aS*,7aS*)-anti-2-Methyl-6,7,9,10-tetrahydro-1H-3a,7a-propanoinden-5-one
SpectraBase Compound ID 4JgNuBfK9j3
InChI InChI=1S/C13H20O/c1-10-7-12-4-2-5-13(12,8-10)9-11(14)3-6-12/h10H,2-9H2,1H3/t10?,12-,13-/m0/s1
InChIKey NFEYMOHOSHZQDI-OLPBLLBXSA-N
Mol Weight 192.3 g/mol
Molecular Formula C13H20O
Exact Mass 192.151415 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 8T2k1BVKXzf
Name (3aS*,7aS*)-anti-2-Methyl-6,7,9,10-tetrahydro-1H-3a,7a-propanoinden-5-one
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C13H20O
InChI InChI=1S/C13H20O/c1-10-7-12-4-2-5-13(12,8-10)9-11(14)3-6-12/h10H,2-9H2,1H3/t10?,12-,13-/m0/s1
InChIKey NFEYMOHOSHZQDI-OLPBLLBXSA-N
Molecular Weight 192.302 g/mol
SMILES [C@]123[C@](CC(C3)C)(CCC(C1)=O)CCC2
SPLASH splash10-0a6u-5900000000-745788f387bf2f6fbb55
Source of Spectrum K1-0-367-35
Synonyms (3aS*,7aS*)-syn-2-Methyl-6,7,9,10-tetrahydro-1H-3a,7a-propanoinden-5-one (1S,6S)-8-methyltricyclo[4.3.3.0(1,6)]dodecan-3-one
Wiley ID 1588231