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2H-Pyrrol-4-ol, 3,4-dihydro-2,2,4-trimethyl-5-phenyl-, 1-oxide
SpectraBase Compound ID GcqA6nR3Zh5
InChI InChI=1S/C13H17NO2/c1-12(2)9-13(3,15)11(14(12)16)10-7-5-4-6-8-10/h4-8,15H,9H2,1-3H3
InChIKey HOLAGESPTBHXPQ-UHFFFAOYSA-N
Mol Weight 219.28 g/mol
Molecular Formula C13H17NO2
Exact Mass 219.125929 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 4kbaEJFZ6FX
Name 2H-Pyrrol-4-ol, 3,4-dihydro-2,2,4-trimethyl-5-phenyl-, 1-oxide
Alternate Name(s) 2,2,4-trimethyl-1-oxido-5-phenyl-3H-pyrrol-1-ium-4-ol 2,2,4-trimethyl-1-oxidanidyl-5-phenyl-3H-pyrrol-1-ium-4-ol
CAS Registry Number 74101-32-9
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C13H17NO2
InChI InChI=1S/C13H17NO2/c1-12(2)9-13(3,15)11(14(12)16)10-7-5-4-6-8-10/h4-8,15H,9H2,1-3H3
InChIKey HOLAGESPTBHXPQ-UHFFFAOYSA-N
Molecular Weight 219.284 g/mol
SMILES OC1(C(=[N+](C(C1)(C)C)[O-])c1ccccc1)C
SPLASH splash10-1003-8490000000-1937e75222019450dd54
Source of Spectrum B-32-2028-0
Wiley ID 1218889