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

*Links on SpectraBase are not permalinks.
2,2-Dimethylpropionic acid, 3-(4-amino-2-oxo-2H-pyrimidin-1-ylmethoxy)-5-benzyloxypentyl ester
SpectraBase Compound ID 8M1ai2ykoTf
InChI InChI=1S/C22H31N3O5/c1-22(2,3)20(26)29-14-11-18(10-13-28-15-17-7-5-4-6-8-17)30-16-25-12-9-19(23)24-21(25)27/h4-9,12,18H,10-11,13-16H2,1-3H3,(H2,23,24,27)
InChIKey NLADUOZYPJBORX-UHFFFAOYSA-N
Mol Weight 417.51 g/mol
Molecular Formula C22H31N3O5
Exact Mass 417.226371 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 HK0LZFpkOUR
Name 2,2-Dimethylpropionic acid, 3-(4-amino-2-oxo-2H-pyrimidin-1-ylmethoxy)-5-benzyloxypentyl ester
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C22H31N3O5
InChI InChI=1S/C22H31N3O5/c1-22(2,3)20(26)29-14-11-18(10-13-28-15-17-7-5-4-6-8-17)30-16-25-12-9-19(23)24-21(25)27/h4-9,12,18H,10-11,13-16H2,1-3H3,(H2,23,24,27)
InChIKey NLADUOZYPJBORX-UHFFFAOYSA-N
Molecular Weight 417.506 g/mol
SMILES NC1=NC(N(COC(CCOC(C(C)(C)C)=O)CCOCc2ccccc2)C=C1)=O
SPLASH splash10-0006-9700000000-e7dd16d5a661a94edffe
Synonyms 3-[(4-Amino-2-oxo-1(2H)-pyrimidinyl)methoxy]-5-(benzyloxy)pentyl pivalate 2,2-Dimethylpropanoic acid [3-[(4-amino-2-oxo-1-pyrimidinyl)methoxy]-5-phenylmethoxypentyl] ester [3-[(4-amino-2-oxopyrimidin-1-yl)methoxy]-5-phenylmethoxypentyl] 2,2-dimethylpropanoate [3-[(4-amino-2-oxo-pyrimidin-1-yl)methoxy]-5-benzyloxy-pentyl] 2,2-dimethylpropanoate [3-[(4-azanyl-2-oxidanylidene-pyrimidin-1-yl)methoxy]-5-phenylmethoxy-pentyl] 2,2-dimethylpropanoate
Wiley ID 1483540