CID 23545028

3-ethyl-3-methylazetidine hydrochloride

Structural Information

Molecular Formula
C6H13N
SMILES
CCC1(CNC1)C
InChI
InChI=1S/C6H13N/c1-3-6(2)4-7-5-6/h7H,3-5H2,1-2H3
InChIKey
JCGWCOCQLMXRKE-UHFFFAOYSA-N
Compound name
3-ethyl-3-methylazetidine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

46
Patents

99.1048 Da
Monoisotopic Mass

1.1
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 100.112076 121.3
[M+Na]+ 122.094018 127.6
[M-H]- 98.097524 122.4
[M+NH4]+ 117.138623 138.3
[M+K]+ 138.067958 129.4
[M+H-H2O]+ 82.102060 112.5
[M+HCOO]- 144.103001 140.8
[M+CH3COO]- 158.118651 168.6
[M+Na-2H]- 120.079466 128.8
[M]+ 99.10425142 127.4
[M]- 99.10534858 127.4
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