Product Name NSC 89775
CAS1606-30-0
MFC4H7NO2
MW101.1
InChIInChI=1S/C4H7NO2/c1-4(2)3-5(6)7/h3H,1-2H3
InChIKeyVXMMUDFDTWWSQT-UHFFFAOYSA-N
SmilesC(/[N+]([O-])=O)=C(\C)/C
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Parameter ppm Hz D(A) 6.89 D(B) 2.12 D(C) 1.93 J(A,B) -1.3 J(A,C) -1.3 J(B,C) 0.0 DESCOTES,G. ET AL. BULL.SOC.CHIM.FR. 1970, 282
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