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Tetrahydro-2-furanylmethyl 4-nitrobenzoate
SpectraBase Compound ID DnXuppjZzS9
InChI InChI=1S/C12H13NO5/c14-12(18-8-11-2-1-7-17-11)9-3-5-10(6-4-9)13(15)16/h3-6,11H,1-2,7-8H2
InChIKey IYGVERJUFJHECS-UHFFFAOYSA-N
Mol Weight 251.24 g/mol
Molecular Formula C12H13NO5
Exact Mass 251.079373 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID I4cxDUmLNZS
Name Tetrahydro-2-furanylmethyl 4-nitrobenzoate
Alternate Name(s) 4-Nitrobenzoic acid, 2-tetrahydrofurylmethyl ester 4-Nitrobenzoic acid 2-oxolanylmethyl ester Tetrahydrofuran-2-ylmethyl 4-nitrobenzoate Oxolan-2-ylmethyl 4-nitrobenzoate
CAS Registry Number 4696-98-4
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C12H13NO5
InChI InChI=1S/C12H13NO5/c14-12(18-8-11-2-1-7-17-11)9-3-5-10(6-4-9)13(15)16/h3-6,11H,1-2,7-8H2
InChIKey IYGVERJUFJHECS-UHFFFAOYSA-N
Molecular Weight 251.238 g/mol
SMILES C1OC(CC1)COC(c1ccc(N(=O)=O)cc1)=O
SPLASH splash10-00di-9100000000-2b7075f668802e403af4
Source of Spectrum NP-7-1577-0
Wiley ID 1106316