CID 43151779

2126176-99-4

Structural Information

Molecular Formula
C11H13NO2
SMILES
C1CC1(C2=CC3=C(C=C2)OCCO3)N
InChI
InChI=1S/C11H13NO2/c12-11(3-4-11)8-1-2-9-10(7-8)14-6-5-13-9/h1-2,7H,3-6,12H2
InChIKey
ONPWHMSLIPYJQL-UHFFFAOYSA-N
Compound name
1-(2,3-dihydro-1,4-benzodioxin-6-yl)cyclopropan-1-amine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

191.09464 Da
Monoisotopic Mass

0.8
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 192.10192 139.2
[M+Na]+ 214.08386 148.4
[M-H]- 190.08736 148.5
[M+NH4]+ 209.12846 153.8
[M+K]+ 230.05780 148.7
[M+H-H2O]+ 174.09190 132.8
[M+HCOO]- 236.09284 159.0
[M+CH3COO]- 250.10849 152.5
[M+Na-2H]- 212.06931 149.2
[M]+ 191.09409 140.4
[M]- 191.09519 140.4
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.