CID 57623274

1,2,2-trimethylpyrrolidin-3-amine dihydrochloride

Structural Information

Molecular Formula
C7H16N2
SMILES
CC1(C(CCN1C)N)C
InChI
InChI=1S/C7H16N2/c1-7(2)6(8)4-5-9(7)3/h6H,4-5,8H2,1-3H3
InChIKey
XKXMIYMWONOXEY-UHFFFAOYSA-N
Compound name
1,2,2-trimethylpyrrolidin-3-amine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

28
Patents

128.13135 Da
Monoisotopic Mass

0.1
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 129.13863 127.1
[M+Na]+ 151.12057 135.2
[M-H]- 127.12407 129.2
[M+NH4]+ 146.16517 151.7
[M+K]+ 167.09451 134.2
[M+H-H2O]+ 111.12861 122.3
[M+HCOO]- 173.12955 149.3
[M+CH3COO]- 187.14520 174.7
[M+Na-2H]- 149.10602 131.3
[M]+ 128.13080 123.9
[M]- 128.13190 123.9
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