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Methyl 2-methyl-1H-azepine-1-carboxylate
SpectraBase Compound ID 6PX0hbHoPEx
InChI InChI=1S/C9H11NO2/c1-8-6-4-3-5-7-10(8)9(11)12-2/h3-7H,1-2H3
InChIKey PYQMJFBPGRBQQT-UHFFFAOYSA-N
Mol Weight 165.19 g/mol
Molecular Formula C9H11NO2
Exact Mass 165.078979 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 4FryB8AbNIE
Name Methyl 2-methyl-1H-azepine-1-carboxylate
Alternate Name(s) 2-Methyl-1-azepinecarboxylic acid methyl ester 2-Methylazepine-1-carboxylic acid methyl ester Methyl 2-methylazepine-1-carboxylate
CAS Registry Number 14194-59-3
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C9H11NO2
InChI InChI=1S/C9H11NO2/c1-8-6-4-3-5-7-10(8)9(11)12-2/h3-7H,1-2H3
InChIKey PYQMJFBPGRBQQT-UHFFFAOYSA-N
Molecular Weight 165.192 g/mol
SMILES C=1N(C(=CC=CC1)C)C(OC)=O
SPLASH splash10-001i-8900000000-d315aafe0e14b0214bf0
Source of Spectrum EP-5618-0-0
Wiley ID 1161465