CID 124582585

1932793-09-3

Structural Information

Molecular Formula
C11H19N5O2
SMILES
CC(C)(C)OC(=O)N1C[C@H]([C@H](C1)N2C=CN=N2)N
InChI
InChI=1S/C11H19N5O2/c1-11(2,3)18-10(17)15-6-8(12)9(7-15)16-5-4-13-14-16/h4-5,8-9H,6-7,12H2,1-3H3/t8-,9+/m1/s1
InChIKey
ULZNGNSUUVUKGF-BDAKNGLRSA-N
Compound name
tert-butyl (3R,4S)-3-amino-4-(triazol-1-yl)pyrrolidine-1-carboxylate
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

1
Patents

253.15387 Da
Monoisotopic Mass

-0.6
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 254.16115 157.5
[M+Na]+ 276.14309 164.7
[M+NH4]+ 271.18769 162.1
[M+K]+ 292.11703 166.3
[M-H]- 252.14659 156.2
[M+Na-2H]- 274.12854 160.3
[M]+ 253.15332 157.6
[M]- 253.15442 157.6
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