CID 5257825

5,5-dimethylpyrrolidin-2-imine hydrochloride

Structural Information

Molecular Formula
C6H12N2
SMILES
CC1(CCC(=N1)N)C
InChI
InChI=1S/C6H12N2/c1-6(2)4-3-5(7)8-6/h3-4H2,1-2H3,(H2,7,8)
InChIKey
CLKGGDYPNPRDSK-UHFFFAOYSA-N
Compound name
5,5-dimethyl-3,4-dihydropyrrol-2-amine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

20
Patents

112.10005 Da
Monoisotopic Mass

-0.3
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 113.107326 121.2
[M+Na]+ 135.089268 129.8
[M-H]- 111.092774 123.5
[M+NH4]+ 130.133873 146.1
[M+K]+ 151.063208 128.8
[M+H-H2O]+ 95.097310 116.2
[M+HCOO]- 157.098251 145.2
[M+CH3COO]- 171.113901 170.1
[M+Na-2H]- 133.074716 127.5
[M]+ 112.09950142 118.6
[M]- 112.10059858 118.6
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