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

74
Patents

141.07898 Da
Monoisotopic Mass

0.1
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 142.08626 128.9
[M+Na]+ 164.06820 138.8
[M-H]- 140.07170 133.7
[M+NH4]+ 159.11280 147.3
[M+K]+ 180.04214 137.2
[M+H-H2O]+ 124.07624 124.7
[M+HCOO]- 186.07718 152.5
[M+CH3COO]- 200.09283 179.2
[M+Na-2H]- 162.05365 134.5
[M]+ 141.07843 131.6
[M]- 141.07953 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