CID 20628330

1096325-48-2

Structural Information

Molecular Formula
C8H18N2
SMILES
CC(C)(C)N1CCC(C1)N
InChI
InChI=1S/C8H18N2/c1-8(2,3)10-5-4-7(9)6-10/h7H,4-6,9H2,1-3H3
InChIKey
UTEZMBDWXGWOQJ-UHFFFAOYSA-N
Compound name
1-tert-butylpyrrolidin-3-amine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

155
Patents

142.147 Da
Monoisotopic Mass

0.5
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 143.154276 134.3
[M+Na]+ 165.136218 140.6
[M-H]- 141.139724 135.9
[M+NH4]+ 160.180823 156.2
[M+K]+ 181.110158 139.7
[M+H-H2O]+ 125.144260 128.8
[M+HCOO]- 187.145201 154.5
[M+CH3COO]- 201.160851 176.7
[M+Na-2H]- 163.121666 138.0
[M]+ 142.14645142 130.2
[M]- 142.14754858 130.2
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