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3-Butenoic acid, 3-methoxy-4-nitro-, methyl ester, (E)-
SpectraBase Compound ID 8ouNdPmvzby
InChI InChI=1S/C6H9NO5/c1-11-5(4-7(9)10)3-6(8)12-2/h4H,3H2,1-2H3/b5-4-
InChIKey FUOFYMSZCQEIQN-PLNGDYQASA-N
Mol Weight 175.14 g/mol
Molecular Formula C6H9NO5
Exact Mass 175.048072 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID EWJppHnQbck
Name 3-Butenoic acid, 3-methoxy-4-nitro-, methyl ester, (E)-
Alternate Name(s) Methyl (3Z)-3-methoxy-4-nitro-3-butenoate (Z)-3-methoxy-4-nitro-3-butenoic acid methyl ester (Z)-3-methoxy-4-nitro-but-3-enoic acid methyl ester Methyl (Z)-3-methoxy-4-nitro-but-3-enoate
CAS Registry Number 87730-90-3
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C6H9NO5
InChI InChI=1S/C6H9NO5/c1-11-5(4-7(9)10)3-6(8)12-2/h4H,3H2,1-2H3/b5-4-
InChIKey FUOFYMSZCQEIQN-PLNGDYQASA-N
Molecular Weight 175.140 g/mol
SMILES C(\C(=C\N(=O)=O)OC)C(=O)OC
SPLASH splash10-102c-9800000000-bd1623babc762119d35d
Source of Spectrum H-66-1487-0
Wiley ID 1171258