CID 30815077

Rac-(1r,2r)-2-phenoxycyclopentan-1-amine hydrochloride

Structural Information

Molecular Formula
C11H15NO
SMILES
C1C[C@H]([C@H](C1)OC2=CC=CC=C2)N
InChI
InChI=1S/C11H15NO/c12-10-7-4-8-11(10)13-9-5-2-1-3-6-9/h1-3,5-6,10-11H,4,7-8,12H2/t10-,11+/m1/s1
InChIKey
WEBWXWDQSPNZHG-MNOVXSKESA-N
Compound name
(1R,2S)-2-phenoxycyclopentan-1-amine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

3
Patents

177.11537 Da
Monoisotopic Mass

1.9
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 178.12265 138.1
[M+Na]+ 200.10459 143.9
[M-H]- 176.10809 144.0
[M+NH4]+ 195.14919 159.2
[M+K]+ 216.07853 141.4
[M+H-H2O]+ 160.11263 131.6
[M+HCOO]- 222.11357 162.1
[M+CH3COO]- 236.12922 180.9
[M+Na-2H]- 198.09004 142.0
[M]+ 177.11482 134.1
[M]- 177.11592 134.1
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

patents stripe