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1-Naphthalenecarboxylic acid, 1,2,3,4-tetrahydro-2-hydroxy-5-methoxy-, methyl ester, (1R-cis)-
SpectraBase Compound ID 8v34xqSVIgC
InChI InChI=1S/C13H16O4/c1-16-11-5-3-4-9-8(11)6-7-10(14)12(9)13(15)17-2/h3-5,10,12,14H,6-7H2,1-2H3/t10-,12+/m0/s1
InChIKey ZGHGKNZGEVADQS-CMPLNLGQSA-N
Mol Weight 236.27 g/mol
Molecular Formula C13H16O4
Exact Mass 236.104859 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 5aqEcWXjihB
Name 1-Naphthalenecarboxylic acid, 1,2,3,4-tetrahydro-2-hydroxy-5-methoxy-, methyl ester, (1R-cis)-
Alternate Name(s) (1R,2R)-1,2,3,4-tetrahydro-2-hydroxy-5-methoxy-1-naphthalinecarbonsaure-methylester Methyl (1R,2S)-2-hydroxy-5-methoxy-1,2,3,4-tetrahydro-1-naphthalenecarboxylate
CAS Registry Number 115753-16-7
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C13H16O4
InChI InChI=1S/C13H16O4/c1-16-11-5-3-4-9-8(11)6-7-10(14)12(9)13(15)17-2/h3-5,10,12,14H,6-7H2,1-2H3/t10-,12+/m0/s1
InChIKey ZGHGKNZGEVADQS-CMPLNLGQSA-N
Molecular Weight 236.267 g/mol
SMILES O[C@@]1([C@@](c2c(c(OC)ccc2)CC1)(C(=O)OC)[H])[H]
SPLASH splash10-0a4i-0910000000-29710b8de498f2d025f0
Source of Spectrum H-70-1612-21
Wiley ID 1238064