CID 60798863

Cyclopentyl(2-methoxyphenyl)methanamine

Structural Information

Molecular Formula
C13H19NO
SMILES
COC1=CC=CC=C1C(C2CCCC2)N
InChI
InChI=1S/C13H19NO/c1-15-12-9-5-4-8-11(12)13(14)10-6-2-3-7-10/h4-5,8-10,13H,2-3,6-7,14H2,1H3
InChIKey
ORVJJSAPXZUNPH-UHFFFAOYSA-N
Compound name
cyclopentyl-(2-methoxyphenyl)methanamine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

205.14667 Da
Monoisotopic Mass

2.6
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 206.15395 148.2
[M+Na]+ 228.13589 152.8
[M-H]- 204.13939 153.8
[M+NH4]+ 223.18049 168.1
[M+K]+ 244.10983 150.3
[M+H-H2O]+ 188.14393 141.3
[M+HCOO]- 250.14487 170.4
[M+CH3COO]- 264.16052 187.8
[M+Na-2H]- 226.12134 149.7
[M]+ 205.14612 144.2
[M]- 205.14722 144.2
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.