For citations & permissions, please see: Citations & Permissions - Wiley Science Solutions*

*Links on SpectraBase are not permalinks.
Brivudine 2AC
SpectraBase Compound ID 81cJIr0bxZX
InChI InChI=1S/C15H17BrN2O7/c1-8(19)23-7-12-11(24-9(2)20)5-13(25-12)18-6-10(3-4-16)14(21)17-15(18)22/h3-4,6,11-13H,5,7H2,1-2H3,(H,17,21,22)/b4-3+
InChIKey XOXDXFVBRHEPDN-ONEGZZNKSA-N
Mol Weight 417.21 g/mol
Molecular Formula C15H17BrN2O7
Exact Mass 416.021914 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

View the Full Spectrum for FREE!

The full spectrum can only be viewed using a FREE account.

SpectraBase Spectrum ID 63mQOJq9Tzc
Name Brivudine 2AC
Classification Virustatic
Copyright Copyright © 2023-2024 Wiley-VCH GmbH. All Rights Reserved.
Exact Mass 416.021913888 u
Formula C15H17N2O7Br
InChI InChI=1S/C15H17BrN2O7/c1-8(19)23-7-12-11(24-9(2)20)5-13(25-12)18-6-10(3-4-16)14(21)17-15(18)22/h3-4,6,11-13H,5,7H2,1-2H3,(H,17,21,22)/b4-3+
InChIKey XOXDXFVBRHEPDN-ONEGZZNKSA-N
Ionization Type Electron Ionization (EI)
Molecular Weight 417.212 g/mol
Related CAS Registry Number(s) 69304-47-8
SMILES C1(OC(COC(=O)C)C(OC(=O)C)C1)N1C=C(C(NC1=O)=O)\C=C\Br
SPLASH splash10-001i-9410000000-85e01ed8f94f6956ae1e
Sample Comments The MMPW Reference Handbook and associated Tables are attached to Record #1, under the Attachments tab. Refer to these references for an explanation of the Sample Preparation Procedure "Detected" abbreviations, as well as other relevant information pertaining to this database.
Source of Spectrum H.H.Maurer, M.Meyer, K.Pfleger, A.A. Weber / University of Saarland, D-66424 Homburg Germany
Technique GC/MS
Wiley ID MMPW6e_8219