CID 62795100

2-[4-(propan-2-yloxy)phenyl]cyclopentan-1-amine

Structural Information

Molecular Formula
C14H21NO
SMILES
CC(C)OC1=CC=C(C=C1)C2CCCC2N
InChI
InChI=1S/C14H21NO/c1-10(2)16-12-8-6-11(7-9-12)13-4-3-5-14(13)15/h6-10,13-14H,3-5,15H2,1-2H3
InChIKey
OGLPMUZEQSBRQN-UHFFFAOYSA-N
Compound name
2-(4-propan-2-yloxyphenyl)cyclopentan-1-amine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

219.16231 Da
Monoisotopic Mass

2.7
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 220.16959 152.5
[M+Na]+ 242.15153 157.7
[M-H]- 218.15503 158.4
[M+NH4]+ 237.19613 172.2
[M+K]+ 258.12547 155.0
[M+H-H2O]+ 202.15957 145.8
[M+HCOO]- 264.16051 174.4
[M+CH3COO]- 278.17616 192.0
[M+Na-2H]- 240.13698 152.8
[M]+ 219.16176 149.4
[M]- 219.16286 149.4
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.