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Carbamic acid butyl ester
SpectraBase Compound ID 51wK6cyQt9r
InChI InChI=1S/C5H11NO2/c1-2-3-4-8-5(6)7/h2-4H2,1H3,(H2,6,7)
InChIKey SKKTUOZKZKCGTB-UHFFFAOYSA-N
Mol Weight 117.15 g/mol
Molecular Formula C5H11NO2
Exact Mass 117.078979 g/mol

Raman Spectrum

Raman Spectrum

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SpectraBase Spectrum ID J86wZWpnkil
Name Carbamic acid, butyl ester
Comments Computed using SmartSpectra Model v1.42
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Exact Mass 117.078978596 u
Formula C5H11NO2
InChI InChI=1S/C5H11NO2/c1-2-3-4-8-5(6)7/h2-4H2,1H3,(H2,6,7)
InChIKey SKKTUOZKZKCGTB-UHFFFAOYSA-N
Molecular Weight 117.148 g/mol
SMILES NC(OCCCC)=O
Spectrum/Structure Validation Score (Raman) 0.933695