CID 11357283

365996-05-0

Structural Information

Molecular Formula
C11H17N3O2S
SMILES
CC(C)(C)OC(=O)N1CCC2=C(C1)SC(=N2)N
InChI
InChI=1S/C11H17N3O2S/c1-11(2,3)16-10(15)14-5-4-7-8(6-14)17-9(12)13-7/h4-6H2,1-3H3,(H2,12,13)
InChIKey
BMLHPGOMLGKYIJ-UHFFFAOYSA-N
Compound name
tert-butyl 2-amino-6,7-dihydro-4H-[1,3]thiazolo[5,4-c]pyridine-5-carboxylate
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

339
Patents

255.10414 Da
Monoisotopic Mass

1.4
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 256.11142 158.1
[M+Na]+ 278.09336 166.3
[M+NH4]+ 273.13796 165.1
[M+K]+ 294.06730 162.4
[M-H]- 254.09686 157.8
[M+Na-2H]- 276.07881 159.9
[M]+ 255.10359 159.3
[M]- 255.10469 159.3
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

Literature stripe

No literature data available for this compound.

Patent stripe

patents stripe