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2-Pentanone, 5-(1,2,3,4-tetrahydro-2-hydroxy-7-methoxy-1-methyl-1-naphthalenyl)-, (1R-trans)-
SpectraBase Compound ID 7Elg4IOBIzr
InChI InChI=1S/C17H24O3/c1-12(18)5-4-10-17(2)15-11-14(20-3)8-6-13(15)7-9-16(17)19/h6,8,11,16,19H,4-5,7,9-10H2,1-3H3/t16-,17-/m1/s1
InChIKey HCCIGOVLQWNRKB-IAGOWNOFSA-N
Mol Weight 276.38 g/mol
Molecular Formula C17H24O3
Exact Mass 276.172545 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID pr6F2DN1RX
Name 2-Pentanone, 5-(1,2,3,4-tetrahydro-2-hydroxy-7-methoxy-1-methyl-1-naphthalenyl)-, (1R-trans)-
CAS Registry Number 112280-81-6
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C17H24O3
InChI InChI=1S/C17H24O3/c1-12(18)5-4-10-17(2)15-11-14(20-3)8-6-13(15)7-9-16(17)19/h6,8,11,16,19H,4-5,7,9-10H2,1-3H3/t16-,17-/m1/s1
InChIKey HCCIGOVLQWNRKB-IAGOWNOFSA-N
Molecular Weight 276.376 g/mol
SMILES O[C@]1([C@@](c2c(CC1)ccc(c2)OC)(CCCC(=O)C)C)[H]
SPLASH splash10-00di-0920000000-89af078e969c3294eb8c
Source of Spectrum I-65-23-13
Synonyms 1-(4'-Oxopentyl)-2-hydroxy-7-methoxy-1(R)-methyl-1,2-dihydronaphthalene 5-[(1R,2R)-2-hydroxy-7-methoxy-1-methyl-1,2,3,4-tetrahydro-1-naphthalenyl]-2-pentanone
Wiley ID 1280342