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3-(2,6,6-Trimethyl-cyclohex-1-enyl)-propionic acid, methyl ester
SpectraBase Compound ID 7tmBLRaVq0D
InChI InChI=1S/C13H22O2/c1-10-6-5-9-13(2,3)11(10)7-8-12(14)15-4/h5-9H2,1-4H3
InChIKey BBUWNSFMAYSTEM-UHFFFAOYSA-N
Mol Weight 210.32 g/mol
Molecular Formula C13H22O2
Exact Mass 210.16198 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 1Blij8eS8Lq
Name 3-(2,6,6-Trimethyl-cyclohex-1-enyl)-propionic acid, methyl ester
CAS Registry Number 91975-60-9
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C13H22O2
InChI InChI=1S/C13H22O2/c1-10-6-5-9-13(2,3)11(10)7-8-12(14)15-4/h5-9H2,1-4H3
InChIKey BBUWNSFMAYSTEM-UHFFFAOYSA-N
Molecular Weight 210.317 g/mol
SMILES C1C(=C(C(CC1)(C)C)CCC(=O)OC)C
SPLASH splash10-022d-7900000000-aadbef64b8211e7ace71
Synonyms 3-(2,6,6-trimethyl-1-cyclohexenyl)propanoic acid methyl ester 3-(2,6,6-trimethylcyclohexen-1-yl)propionic acid methyl ester Methyl 3-(2,6,6-trimethylcyclohexen-1-yl)propanoate Methyl 3-(2,6,6-trimethyl-1-cyclohexen-1-yl)propanoate
Wiley ID 1481798