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3-HYDROXY-6-METHOXYPRIMNATRIENONE

View entire compound with spectra: 3 NMR, and 1 MS (GC)

3-HYDROXY-6-METHOXYPRIMNATRIENONE
SpectraBase Compound ID 7ZmGuG5m7XS
InChI InChI=1S/C16H22O3/c1-8(2)10-7-11(19-6)9(3)12-13(10)15(18)16(4,5)14(12)17/h7-8,15,18H,1-6H3
InChIKey JZEWYUNZPHTUFX-UHFFFAOYSA-N
Mol Weight 262.35 g/mol
Molecular Formula C16H22O3
Exact Mass 262.156895 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 8DOcLkpURmd
Name 3-Hydroxy-4-isopropyl-6-methoxy-2,2,7-trimethyl-indan-1-one
Alternate Name(s) 3-Hydroxy-6-methoxy-2,2,7-trimethyl-4-propan-2-yl-3H-inden-1-one 6-Methoxy-2,2,7-trimethyl-3-oxidanyl-4-propan-2-yl-3H-inden-1-one
CAS Registry Number 116173-38-7
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C16H22O3
InChI InChI=1S/C16H22O3/c1-8(2)10-7-11(19-6)9(3)12-13(10)15(18)16(4,5)14(12)17/h7-8,15,18H,1-6H3
InChIKey JZEWYUNZPHTUFX-UHFFFAOYSA-N
Molecular Weight 262.349 g/mol
SMILES OC1C(C(c2c1c(C(C)C)cc(c2C)OC)=O)(C)C
SPLASH splash10-01r5-2590000000-b1fe465045ddc8a13bb2
Source of Spectrum B-41-370-4
Wiley ID 1266124