CID 43632389

1909286-83-4

Structural Information

Molecular Formula
C11H15NO
SMILES
COC1=CC=CC(=C1)C2CC(C2)N
InChI
InChI=1S/C11H15NO/c1-13-11-4-2-3-8(7-11)9-5-10(12)6-9/h2-4,7,9-10H,5-6,12H2,1H3
InChIKey
QTNLQBOTFHWSGT-UHFFFAOYSA-N
Compound name
3-(3-methoxyphenyl)cyclobutan-1-amine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

177.11537 Da
Monoisotopic Mass

2.0
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 178.12265 136.3
[M+Na]+ 200.10459 142.2
[M-H]- 176.10809 142.5
[M+NH4]+ 195.14919 149.7
[M+K]+ 216.07853 143.1
[M+H-H2O]+ 160.11263 124.7
[M+HCOO]- 222.11357 159.0
[M+CH3COO]- 236.12922 187.2
[M+Na-2H]- 198.09004 141.0
[M]+ 177.11482 143.2
[M]- 177.11592 143.2
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

No patent data available for this compound.