CID 57145577

N3,n3-dimethylpyrrolidine-3,4-diamine trihydrochloride

Structural Information

Molecular Formula
C6H15N3
SMILES
CN(C)C1CNCC1N
InChI
InChI=1S/C6H15N3/c1-9(2)6-4-8-3-5(6)7/h5-6,8H,3-4,7H2,1-2H3
InChIKey
UVCYEBCDODRTLL-UHFFFAOYSA-N
Compound name
3-N,3-N-dimethylpyrrolidine-3,4-diamine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

2
Patents

129.1266 Da
Monoisotopic Mass

-1.2
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 130.13388 128.9
[M+Na]+ 152.11582 134.3
[M-H]- 128.11932 130.5
[M+NH4]+ 147.16042 150.5
[M+K]+ 168.08976 133.9
[M+H-H2O]+ 112.12386 122.4
[M+HCOO]- 174.12480 151.3
[M+CH3COO]- 188.14045 176.7
[M+Na-2H]- 150.10127 132.0
[M]+ 129.12605 123.2
[M]- 129.12715 123.2
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