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

23
Patents

114.079315 Da
Monoisotopic Mass

-1.2
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 115.086591 126.9
[M+Na]+ 137.068533 132.3
[M-H]- 113.072039 127.4
[M+NH4]+ 132.113138 142.2
[M+K]+ 153.042473 134.3
[M+H-H2O]+ 97.076575 117.0
[M+HCOO]- 159.077516 146.2
[M+CH3COO]- 173.093166 171.4
[M+Na-2H]- 135.053981 132.3
[M]+ 114.07876642 130.7
[M]- 114.07986358 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