(4aS,7aR)-3-Propyl-1-(2-thienylmethyl)tetrahydro-1H-pyrrolo[3,2-d]pyrimidine-2,4(3H,4aH)-dione

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Systematic / IUPAC Name: (4aS,7aR)-3-Propyl-1-(thiophen-2-ylmethyl)-5,6,7,7a-tetrahydro-4aH-pyrrolo[3,2-d]pyrimidine-2,4-dione

ID: Reference10211

Other Names: 1H-Pyrrolo[3,2-d]pyrimidine-2,4(3H,4aH)-dione, tetrahydro-3-propyl-1-(2-thienylmethyl)-, (4aS,7aR)-;
NAT3-281220

Formula: C14H19N3O2S

Spectral Data

(4aS,7aR)-3-Propyl-1-(2-thienylmethyl)tetrahydro-1H-pyrrolo[3,2-d]pyrimidine-2,4(3H,4aH)-dione mass spectral data can be found in a separate interface. The data are manually curated and of the highest quality.

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Available MS Data

Used Instruments Orbitrap Fusion Lumos with ETD LBP
No. of Spectral Trees 1
No. of Spectra 589
Tandem Spectra MS1, MS2, MS3, MS4
Ionization Methods NSI
Analyzers FT
Last Modification 1/29/2021 3:02:53 PM
View Mass Spec Data > >

Identificators

InChI InChI=1S/C14H19N3O2S/c1-2-7-16-13(18)12-11(5-6-15-12)17(14(16)19)9-10-4-3-8-20-10/h3-4,8,11-12,15H,2,5-7,9H2,1H3/t11-,12+/m1/s1
InChI Key WKNCCMQNGDQYLF-NEPJUHHUSA-N
Canonical SMILES CCCN1C(=O)C2C(CCN2)N(C1=O)CC3=CC=CS3
CAS
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Other Names 1H-Pyrrolo[3,2-d]pyrimidine-2,4(3H,4aH)-dione, tetrahydro-3-propyl-1-(2-thienylmethyl)-, (4aS,7aR)-;
NAT3-281220

In Other Databases

PubChem 26763194
ChemSpider 21383717