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D-glycero-D-allo-Heptonamide, 3,6-anhydro-4,5-O-(1-methylethylidene)-7-O-(phenylmethyl)-, 2-acetate
SpectraBase Compound ID 85pbDMtSBQN
InChI InChI=1S/C19H25NO7/c1-11(21)24-17(18(20)22)15-16-14(26-19(2,3)27-16)13(25-15)10-23-9-12-7-5-4-6-8-12/h4-8,13-17H,9-10H2,1-3H3,(H2,20,22)
InChIKey FLSNVJUWUNXSNJ-UHFFFAOYSA-N
Mol Weight 379.41 g/mol
Molecular Formula C19H25NO7
Exact Mass 379.163102 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 2k2I5lkmYQb
Name D-glycero-D-allo-Heptonamide, 3,6-anhydro-4,5-O-(1-methylethylidene)-7-O-(phenylmethyl)-, 2-acetate
Alternate Name(s) 2-O-acetyl-3,6-anhydro-7-O-benzyl-4,5-O-isopropylidene-D-glycero-D-(alllo and (altro)-heptonamides Furo[3,4-d]-1,3-dioxole, D-glycero-D-allo-heptonamide deriv. {6-[(benzyloxy)methyl]-2,2-dimethyl-tetrahydro-2H-furo[3,4-d][1,3]dioxol-4-yl}(carbamoyl)methyl acetate
CAS Registry Number 86040-35-9
Comments Less than 3 mono-isotopic peaks
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C19H25NO7
InChI InChI=1S/C19H25NO7/c1-11(21)24-17(18(20)22)15-16-14(26-19(2,3)27-16)13(25-15)10-23-9-12-7-5-4-6-8-12/h4-8,13-17H,9-10H2,1-3H3,(H2,20,22)
InChIKey FLSNVJUWUNXSNJ-UHFFFAOYSA-N
Molecular Weight 379.409 g/mol
SMILES NC(C(C1C2C(OC(O2)(C)C)C(O1)COCc1ccccc1)OC(=O)C)=O
SPLASH splash10-03di-0009000000-b6c1434a1852b1709a1b
Source of Spectrum I-61-320-5
Wiley ID 1359230