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Ethanamine, 2-(1,3-benzodioxol-5-yloxy)-
SpectraBase Compound ID 9bPi31XJKAC
InChI InChI=1S/C9H11NO3/c10-3-4-11-7-1-2-8-9(5-7)13-6-12-8/h1-2,5H,3-4,6,10H2
InChIKey ZMEQUDXFAHZUPR-UHFFFAOYSA-N
Mol Weight 181.19 g/mol
Molecular Formula C9H11NO3
Exact Mass 181.073893 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 8VQ65lEle9q
Name Ethanamine, 2-(1,3-benzodioxol-5-yloxy)-
Alternate Name(s) 2-(1,3-Benzodioxol-5-yloxy)ethanamine 2-(1,3-benzodioxol-5-yloxy)ethylamine
CAS Registry Number 72955-85-2
Comments Less than 3 mono-isotopic peaks
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Formula C9H11NO3
InChI InChI=1S/C9H11NO3/c10-3-4-11-7-1-2-8-9(5-7)13-6-12-8/h1-2,5H,3-4,6,10H2
InChIKey ZMEQUDXFAHZUPR-UHFFFAOYSA-N
Molecular Weight 181.191 g/mol
SMILES NCCOc1cc2c(OCO2)cc1
SPLASH splash10-000i-0900000000-4bae29f753a0fed04a14
Source of Spectrum B-37-135-0
Wiley ID 1177381