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1,2,5-Naphthalenetriol, 1,2-dihydro-, 5-(methylcarbamate)

View entire compound with spectra: 1 MS (GC)

1,2,5-Naphthalenetriol, 1,2-dihydro-, 5-(methylcarbamate)
SpectraBase Compound ID C0ijb1pFyQM
InChI InChI=1S/C12H13NO4/c1-13-12(16)17-10-4-2-3-8-7(10)5-6-9(14)11(8)15/h2-6,9,11,14-15H,1H3,(H,13,16)
InChIKey YFHMZQOVLAGRRU-UHFFFAOYSA-N
Mol Weight 235.24 g/mol
Molecular Formula C12H13NO4
Exact Mass 235.084458 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID JzPs3MXv1Ru
Name 1,2,5-Naphthalenetriol, 1,2-dihydro-, 5-(methylcarbamate)
Alternate Name(s) (5,6-dihydroxy-5,6-dihydronaphthalen-1-yl) N-methylcarbamate 1,2-Dihydro-1,2,5-naphthalenetriol 5-(methylcarbamate) 5,6-Dihydrodihydroxycarbaryl N-methylcarbamic acid (5,6-dihydroxy-5,6-dihydronaphthalen-1-yl) ester
CAS Registry Number 5375-49-5
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C12H13NO4
InChI InChI=1S/C12H13NO4/c1-13-12(16)17-10-4-2-3-8-7(10)5-6-9(14)11(8)15/h2-6,9,11,14-15H,1H3,(H,13,16)
InChIKey YFHMZQOVLAGRRU-UHFFFAOYSA-N
Molecular Weight 235.239 g/mol
SMILES OC1c2c(c(OC(=O)NC)ccc2)C=CC1O
SPLASH splash10-053r-7900000000-47eca7336724aa56a33e
Source of Spectrum W-23-634-6
Wiley ID 31897