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5,6,7,7a-Tetrahydro-4,4,7a-trimethyl-2-(4H)benzofuranone
SpectraBase Compound ID EcN8MUmCtp2
InChI InChI=1S/C11H16O2/c1-10(2)5-4-6-11(3)8(10)7-9(12)13-11/h7H,4-6H2,1-3H3
InChIKey IMKHDCBNRDRUEB-UHFFFAOYSA-N
Mol Weight 180.25 g/mol
Molecular Formula C11H16O2
Exact Mass 180.11503 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 9ZDdIP8dKzF
Name 2(4H)-Benzofuranone,5,6,7,7a-tetrahydro-4,4,7a-trimethyl-
CAS Registry Number 15356-74-8
Classification Scent, flavor
Copyright Copyright © 2024 DigiLab GmbH and Wiley-VCH GmbH. All Rights Reserved.
Exact Mass 180.115029753 u
Formula C11H16O2
InChI InChI=1S/C11H16O2/c1-10(2)5-4-6-11(3)8(10)7-9(12)13-11/h7H,4-6H2,1-3H3
InChIKey IMKHDCBNRDRUEB-UHFFFAOYSA-N
Ionization Type Electron Ionization (EI)
Molecular Weight 180.247 g/mol
Nominal Mass 180 u
Quality 985
SMILES C1=2C(OC(C2)=O)(CCCC1(C)C)C
SPLASH splash10-01p6-9600000000-a52820dd30338dd7c7ef
Source of Spectrum DigiLab GmbH (C) 2024
Synonyms 4,4,7a-trimethyl-5,6,7,7a-tetrahydro-1-benzofuran-2(4H)-one
Technique GC/MS
Wiley ID DD2024_034623