CID 24273703

1221723-81-4

Structural Information

Molecular Formula
C12H17NO
SMILES
COC1=CC=C(C=C1)C2(CCCC2)N
InChI
InChI=1S/C12H17NO/c1-14-11-6-4-10(5-7-11)12(13)8-2-3-9-12/h4-7H,2-3,8-9,13H2,1H3
InChIKey
AXOUBGWNQDCRAW-UHFFFAOYSA-N
Compound name
1-(4-methoxyphenyl)cyclopentan-1-amine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

4
Patents

191.13101 Da
Monoisotopic Mass

1.8
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 192.13829 143.6
[M+Na]+ 214.12023 154.6
[M+NH4]+ 209.16483 154.5
[M+K]+ 230.09417 147.7
[M-H]- 190.12373 148.1
[M+Na-2H]- 212.10568 152.3
[M]+ 191.13046 146.5
[M]- 191.13156 146.5
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.