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1H-3a,6-Methanoazulene-3-carboxylic acid, 2,3,4,5,6,7-hexahydro-7,7,8-trimethyl-, [3S-(3.alpha.,3a.alpha.,6.alpha.)]-
SpectraBase Compound ID 73peckC4sH7
InChI InChI=1S/C15H22O2/c1-9-11-4-5-12(13(16)17)15(11)7-6-10(8-15)14(9,2)3/h10,12H,4-8H2,1-3H3,(H,16,17)
InChIKey DHPMFKAJSXGYDJ-UHFFFAOYSA-N
Mol Weight 234.34 g/mol
Molecular Formula C15H22O2
Exact Mass 234.16198 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 1zefTa0zXk
Name 1H-3a,6-Methanoazulene-3-carboxylic acid, 2,3,4,5,6,7-hexahydro-7,7,8-trimethyl-, [3S-(3.alpha.,3a.alpha.,6.alpha.)]-
CAS Registry Number 16202-79-2
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C15H22O2
InChI InChI=1S/C15H22O2/c1-9-11-4-5-12(13(16)17)15(11)7-6-10(8-15)14(9,2)3/h10,12H,4-8H2,1-3H3,(H,16,17)
InChIKey DHPMFKAJSXGYDJ-UHFFFAOYSA-N
Molecular Weight 234.339 g/mol
SMILES OC(C1C23C(=C(C(C(C3)CC2)(C)C)C)CC1)=O
SPLASH splash10-00l7-4940000000-88158f07e675c0e6345c
Source of Spectrum AD-0-906-0
Synonyms Isokhusenic acid 1H-3a.alpha.,6-Methanoazulene-3-carboxylic acid, 2,3.beta.,4,5,6.beta.,7-hexahydro-7,7,8-trimethyl- Isozizanoic acid 1H-3a,6-Methanoazulene-3-carboxylic acid, 2,3,4,5,6,7-hexahydro-7,7,8-trimethyl-, (3S,3aS,6R)- 7,7,8-trimethyl-2,3,4,5,6,7-hexahydro-1H-3a,6-methanoazulene-3-carboxylic acid
Wiley ID 1236339