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5H-1-Benzopyran-5-one, 2,3,4,6,7,8-hexahydro-2,2-dimethyl-
SpectraBase Compound ID I5lUGMBFWbJ
InChI InChI=1S/C11H16O2/c1-11(2)7-6-8-9(12)4-3-5-10(8)13-11/h3-7H2,1-2H3
InChIKey CJNBPLSUXNOMEN-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 KphN6YxigiZ
Name 5H-1-Benzopyran-5-one, 2,3,4,6,7,8-hexahydro-2,2-dimethyl-
Alternate Name(s) 2,2-Dimethyl-2,3,4,6,7,8-hexahydro-5H-chromen-5-one 5,6,7,8-Tetrahydro-2,2-dimethyl-5-chromanone
CAS Registry Number 57545-47-8
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C11H16O2
InChI InChI=1S/C11H16O2/c1-11(2)7-6-8-9(12)4-3-5-10(8)13-11/h3-7H2,1-2H3
InChIKey CJNBPLSUXNOMEN-UHFFFAOYSA-N
Molecular Weight 180.247 g/mol
SMILES C12=C(OC(CC2)(C)C)CCCC1=O
SPLASH splash10-002r-2900000000-ccadeeb2ed5e5c4b86f6
Source of Spectrum AN-84-764-0
Wiley ID 1176479