CID 14949211

3,3-dimethylpyrrolidine

Structural Information

Molecular Formula
C6H13N
SMILES
CC1(CCNC1)C
InChI
InChI=1S/C6H13N/c1-6(2)3-4-7-5-6/h7H,3-5H2,1-2H3
InChIKey
XBQNZPDIRJPFAI-UHFFFAOYSA-N
Compound name
3,3-dimethylpyrrolidine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

1494
Patents

99.1048 Da
Monoisotopic Mass

1.1
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 100.11208 121.0
[M+Na]+ 122.09402 128.0
[M-H]- 98.097524 121.7
[M+NH4]+ 117.13862 145.9
[M+K]+ 138.06796 126.9
[M+H-H2O]+ 82.102060 116.3
[M+HCOO]- 144.10300 141.6
[M+CH3COO]- 158.11865 162.7
[M+Na-2H]- 120.07947 127.0
[M]+ 99.104251 116.5
[M]- 99.105349 116.5
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

No patent data available for this compound.