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N4-Benzoyl-2'-deoxycytidine
SpectraBase Compound ID 2iH0Arm2Bky
InChI InChI=1S/C16H17N3O5/c20-9-12-11(21)8-14(24-12)19-7-6-13(18-16(19)23)17-15(22)10-4-2-1-3-5-10/h1-7,11-12,14,20-21H,8-9H2,(H,17,18,22,23)/t11-,12+,14+/m0/s1
InChIKey MPSJHJFNKMUKCN-OUCADQQQSA-N
Mol Weight 331.33 g/mol
Molecular Formula C16H17N3O5
Exact Mass 331.116821 g/mol

Raman Spectrum

Raman Spectrum

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SpectraBase Spectrum ID F3TSyrTWfii
Name N4-Benzoyl-2'-deoxycytidine
Source of Sample Sigma-Aldrich Company LLC
Catalog Number 258474
Lot Number 06130JS
CAS Registry Number 4836-13-9
Cell Type NMR tube
Compound Type Pure
Copyright Copyright © 2015-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C16H17N3O5
InChI InChI=1S/C16H17N3O5/c20-9-12-11(21)8-14(24-12)19-7-6-13(18-16(19)23)17-15(22)10-4-2-1-3-5-10/h1-7,11-12,14,20-21H,8-9H2,(H,17,18,22,23)/t11-,12+,14+/m0/s1
InChIKey MPSJHJFNKMUKCN-OUCADQQQSA-N
Raman Corrections Referenced to internal white light source; 180 degree backscatter
Raman Laser Power 597 mW
Raman Laser Source Nd:YAG
SMILES N(\C=1\C=C/N([C@]2(C[C@@]([C@](O2)(CO)[H])(O)[H])[H])C(N\1)=O)C(=O)c1ccccc1
Scans Performed 2048
Source of Spectrum Forensic Spectral Research
Synonyms N-Benzoyl-2'-deoxycytidine
Technique FT-Raman