CID 22082901

1185307-84-9

Structural Information

Molecular Formula
C7H11NO2
SMILES
COC(=O)C1(CC1C=C)N
InChI
InChI=1S/C7H11NO2/c1-3-5-4-7(5,8)6(9)10-2/h3,5H,1,4,8H2,2H3
InChIKey
HEPZUSCSZCGDFO-UHFFFAOYSA-N
Compound name
methyl 1-amino-2-ethenylcyclopropane-1-carboxylate
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

82
Patents

141.07898 Da
Monoisotopic Mass

0.1
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 142.086256 128.9
[M+Na]+ 164.068198 138.8
[M-H]- 140.071704 133.7
[M+NH4]+ 159.112803 147.3
[M+K]+ 180.042138 137.2
[M+H-H2O]+ 124.076240 124.7
[M+HCOO]- 186.077181 152.5
[M+CH3COO]- 200.092831 179.2
[M+Na-2H]- 162.053646 134.5
[M]+ 141.07843142 131.6
[M]- 141.07952858 131.6
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