CID 15812154

77570-31-1

Structural Information

Molecular Formula
C8H13NO2
SMILES
CCOC(=O)/C=C(/C1CC1)\N
InChI
InChI=1S/C8H13NO2/c1-2-11-8(10)5-7(9)6-3-4-6/h5-6H,2-4,9H2,1H3/b7-5-
InChIKey
SJAOFPHBAYOIAX-ALCCZGGFSA-N
Compound name
ethyl (Z)-3-amino-3-cyclopropylprop-2-enoate
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

5
Patents

155.09464 Da
Monoisotopic Mass

1.1
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 156.101916 133.6
[M+Na]+ 178.083858 141.4
[M-H]- 154.087364 137.7
[M+NH4]+ 173.128463 149.2
[M+K]+ 194.057798 139.2
[M+H-H2O]+ 138.091900 127.6
[M+HCOO]- 200.092841 156.5
[M+CH3COO]- 214.108491 181.6
[M+Na-2H]- 176.069306 137.1
[M]+ 155.09409142 135.2
[M]- 155.09518858 135.2
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