CID 165751652

2803863-25-2

Structural Information

Molecular Formula
C9H15NO2
SMILES
CCOC(=O)C1(CC(=C)C1)CN
InChI
InChI=1S/C9H15NO2/c1-3-12-8(11)9(6-10)4-7(2)5-9/h2-6,10H2,1H3
InChIKey
JWWVUWNSNPKVOL-UHFFFAOYSA-N
Compound name
ethyl 1-(aminomethyl)-3-methylidenecyclobutane-1-carboxylate
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

169.11028 Da
Monoisotopic Mass

0.1
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 170.117556 140.0
[M+Na]+ 192.099498 145.2
[M-H]- 168.103004 143.1
[M+NH4]+ 187.144103 155.3
[M+K]+ 208.073438 147.1
[M+H-H2O]+ 152.107540 130.5
[M+HCOO]- 214.108481 161.1
[M+CH3COO]- 228.124131 184.7
[M+Na-2H]- 190.084946 143.2
[M]+ 169.10973142 147.6
[M]- 169.11082858 147.6
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

No patent data available for this compound.