CID 139026865

2361625-37-6

Structural Information

Molecular Formula
C10H15NO2
SMILES
COC(=O)[C@@H](C1=CCC2CC2C1)N
InChI
InChI=1S/C10H15NO2/c1-13-10(12)9(11)7-3-2-6-4-8(6)5-7/h3,6,8-9H,2,4-5,11H2,1H3/t6?,8?,9-/m1/s1
InChIKey
AVTOZYDOBMPRKT-KPIFQKDSSA-N
Compound name
methyl (2R)-2-amino-2-(3-bicyclo[4.1.0]hept-3-enyl)acetate
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

181.11028 Da
Monoisotopic Mass

0.7
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 182.11756 138.8
[M+Na]+ 204.09950 149.7
[M+NH4]+ 199.14410 147.6
[M+K]+ 220.07344 146.4
[M-H]- 180.10300 147.1
[M+Na-2H]- 202.08495 144.9
[M]+ 181.10973 143.5
[M]- 181.11083 143.5
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.