CID 118967797

3-methylazetidine-3-carboxamide hydrochloride

Structural Information

Molecular Formula
C5H10N2O
SMILES
CC1(CNC1)C(=O)N
InChI
InChI=1S/C5H10N2O/c1-5(4(6)8)2-7-3-5/h7H,2-3H2,1H3,(H2,6,8)
InChIKey
QHPGPVUYRVXSSO-UHFFFAOYSA-N
Compound name
3-methylazetidine-3-carboxamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

22
Patents

114.079315 Da
Monoisotopic Mass

-1.2
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 115.08659 126.9
[M+Na]+ 137.06853 132.3
[M-H]- 113.07204 127.4
[M+NH4]+ 132.11314 142.2
[M+K]+ 153.04247 134.3
[M+H-H2O]+ 97.076575 117.0
[M+HCOO]- 159.07752 146.2
[M+CH3COO]- 173.09317 171.4
[M+Na-2H]- 135.05398 132.3
[M]+ 114.07877 130.7
[M]- 114.07986 130.7
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