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

159
Patents

142.147 Da
Monoisotopic Mass

0.5
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 143.15428 134.3
[M+Na]+ 165.13622 140.6
[M-H]- 141.13972 135.9
[M+NH4]+ 160.18082 156.2
[M+K]+ 181.11016 139.7
[M+H-H2O]+ 125.14426 128.8
[M+HCOO]- 187.14520 154.5
[M+CH3COO]- 201.16085 176.7
[M+Na-2H]- 163.12167 138.0
[M]+ 142.14645 130.2
[M]- 142.14755 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